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(2E)-2-cyano-3-(2,3-dimethoxyphenyl)-N-(4-methoxy-2-nitrophenyl)prop-2-enamide

(2E)-2-cyano-3-(2,3-dimethoxyphenyl)-N-(4-methoxy-2-nitrophenyl)prop-2-enamide

Formula: C19H17N3O6

SMILES: COC1=CC=C(NC(=O)C(=CC2=CC=CC(OC)=C2OC)C#N)C(=C1)[N+]([O-])=O

IUPAC: (2E)-2-cyano-3-(2,3-dimethoxyphenyl)-N-(4-methoxy-2-nitrophenyl)prop-2-enamide

InChI: InChI=1S/C19H17N3O6/c1-26-14-7-8-15(16(10-14)22(24)25)21-19(23)13(11-20)9-12-5-4-6-17(27-2)18(12)28-3/h4-10H,1-3H3,(H,21,23)/b13-9+

Composition: C (59.53%), H (4.47%), N (10.96%), O (25.04%)

Molar Mass: 383.36

Atom Count: 45

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 383.111735279
Formal Charge 0
FSP3 0.16
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 1
InChIKey MEUKUMJHFKRKHR-UKTHLTGXSA-N
Lipinski's Rule of Five 1
Molar Refractivity 102.1
Topological Polar Surface Area 123.72
Polarizability 37.58
Ring Count 2
Rotatable Bond Count 7

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H17N3O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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