ethyl 6-[(phenylmethyl)-prop-2-enyl-amino]-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: ethyl 6-[(phenylmethyl)-prop-2-enyl-amino]-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 6-[allyl(benzyl)amino]-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 6-[(phenylmethyl)-prop-2-enylamino]-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[benzyl(prop-2-enyl)amino]-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-[allyl(benzyl)amino]-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=C2C(=C1)C3=C(N2)C=CC(=C3)N(CC=C)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NC=C2C(=C1)C3=C(N2)C=CC(=C3)N(CC=C)CC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O2/c1-3-12-27(16-17-8-6-5-7-9-17)18-10-11-21-19(13-18)20-14-22(24(28)29-4-2)25-15-23(20)26-21/h3,5-11,13-15,26H,1,4,12,16H2,2H3