ethyl 5-(benzyloxy)-1H-indole-2-carboxylate

ethyl 5-(benzyloxy)-1H-indole-2-carboxylate

CAS: 37033-95-7

Formula: C18H17NO3

SMILES: CCOC(=O)C1=CC2=CC(OCC3=CC=CC=C3)=CC=C2N1

IUPAC: ethyl 5-(benzyloxy)-1H-indole-2-carboxylate

InChI: InChI=1S/C18H17NO3/c1-2-21-18(20)17-11-14-10-15(8-9-16(14)19-17)22-12-13-6-4-3-5-7-13/h3-11,19H,2,12H2,1H3

Composition: C (73.20%), H (5.80%), N (4.74%), O (16.25%)

Molar Mass: 295.338

Atom Count: 39

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	295.120843411
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DCIFXYFKVKDOLL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.87
Topological Polar Surface Area	51.32
Polarizability	33.93
Ring Count	3
Rotatable Bond Count	6

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