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methyl 2-{6'-ethenyl-2-oxo-3',5',6',7',8',8'a-hexahydro-1H,2'H-spiro[indole-3,1'-indolizin]-7'-yl}-3-methoxyprop-2-enoate

methyl 2-{6'-ethenyl-2-oxo-3',5',6',7',8',8'a-hexahydro-1H,2'H-spiro[indole-3,1'-indolizin]-7'-yl}-3-methoxyprop-2-enoate

CAS: 51014-29-0

Formula: C22H26N2O4

SMILES: COC=C(C1CC2N(CCC22C(=O)NC3=CC=CC=C23)CC1C=C)C(=O)OC

IUPAC: methyl 2-{6'-ethenyl-2-oxo-1,2,3',5',6',7',8',8'a-octahydro-2'H-spiro[indole-3,1'-indolizin]-7'-yl}-3-methoxyprop-2-enoate

InChI: InChI=1/C22H26N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h4-8,13-15,19H,1,9-12H2,2-3H3,(H,23,26)

Composition: C (69.09%), H (6.85%), N (7.32%), O (16.73%)

Molar Mass: 382.46

Atom Count: 54

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 4
Exact Mass 382.189257325
Formal Charge 0
FSP3 0.45
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey MUVGVMUWMAGNSY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 108.05
Topological Polar Surface Area 67.87
Polarizability 41.3
Ring Count 4
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 51014-29-0 $93.26$93.26
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