ethyl 1-(4-cyanocyclohex-2-en-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: ethyl 1-(4-cyanocyclohex-2-en-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 1-(4-cyanocyclohex-2-en-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(4-cyano-1-cyclohex-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-cyanocyclohex-2-en-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(4-cyanocyclohex-2-en-1-yl)-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4CCC(C=C4)C#N

Isomeric SMILES

CCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4CCC(C=C4)C#N

InChI

InChI=1S/C21H19N3O2/c1-2-26-21(25)18-11-16-15-5-3-4-6-17(15)23-20(16)19(24-18)14-9-7-13(12-22)8-10-14/h3-7,9,11,13-14,23H,2,8,10H2,1H3