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

Systemtic Name: ethyl 1-(4-nitrocyclohex-2-en-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 1-(4-nitrocyclohex-2-en-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-(4-nitro-1-cyclohex-2-enyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-nitrocyclohex-2-en-1-yl)-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-(4-nitrocyclohex-2-en-1-yl)-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4CCC(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4CCC(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4/c1-2-27-20(24)17-11-15-14-5-3-4-6-16(14)21-19(15)18(22-17)12-7-9-13(10-8-12)23(25)26/h3-7,9,11-13,21H,2,8,10H2,1H3