ethyl 6-(azepan-1-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: ethyl 6-(azepan-1-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 6-(azepan-1-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 6-(1-azepanyl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(azepan-1-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-(azepan-1-yl)-4-methyl-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=C2C(=C1C)C3=C(N2)C=CC(=C3)N4CCCCCC4

Isomeric SMILES

CCOC(=O)C1=NC=C2C(=C1C)C3=C(N2)C=CC(=C3)N4CCCCCC4

InChI

InChI=1S/C21H25N3O2/c1-3-26-21(25)20-14(2)19-16-12-15(24-10-6-4-5-7-11-24)8-9-17(16)23-18(19)13-22-20/h8-9,12-13,23H,3-7,10-11H2,1-2H3