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

Systemtic Name: ethyl 1-[4-(dimethylamino)cyclohex-2-en-1-yl]-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 1-[4-(dimethylamino)cyclohex-2-en-1-yl]-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-[4-(dimethylamino)-1-cyclohex-2-enyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(dimethylamino)cyclohex-2-en-1-yl]-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-[4-(dimethylamino)cyclohex-2-en-1-yl]-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2/c1-4-27-22(26)19-13-17-16-7-5-6-8-18(16)23-21(17)20(24-19)14-9-11-15(12-10-14)25(2)3/h5-9,11,13-15,23H,4,10,12H2,1-3H3