propyl 3-(4-fluorophenyl)carbonyl-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxylate

Systemtic Name: propyl 3-(4-fluorophenyl)carbonyl-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxylate Openeye Name: propyl 3-(4-fluorobenzoyl)-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxylate CAS Name: 3-[(4-fluorophenyl)-oxomethyl]-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxylic acid propyl ester IUPAC Name: propyl 3-(4-fluorobenzoyl)-2-methyl-2,6-dihydro-1H-azepino[4,5-b]indole-5-carboxylate Traditional Name: 3-(4-fluorobenzoyl)-2-methyl-2,6-dihydro-1H-azepin[4,5-b]indole-5-carboxylic acid propyl ester Formula: C24H23FN2O3 MolecularWeight: 406.449423

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CN(C(CC2=C1NC3=CC=CC=C23)C)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCCOC(=O)C1=CN(C(CC2=C1NC3=CC=CC=C23)C)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H23FN2O3/c1-3-12-30-24(29)20-14-27(23(28)16-8-10-17(25)11-9-16)15(2)13-19-18-6-4-5-7-21(18)26-22(19)20/h4-11,14-15,26H,3,12-13H2,1-2H3