methyl 1-(4-nitrophenyl)carbonylspiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclopentene]-1'-carboxylate

Systemtic Name: methyl 1-(4-nitrophenyl)carbonylspiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclopentene]-1'-carboxylate Openeye Name: methyl 1-(4-nitrobenzoyl)spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclopentene]-1'-carboxylate CAS Name: 1-[(4-nitrophenyl)-oxomethyl]-1'-spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclopentene]carboxylic acid methyl ester IUPAC Name: methyl 1-(4-nitrobenzoyl)spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclopentene]-1'-carboxylate Traditional Name: 1-(4-nitrobenzoyl)spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclopentene]-1'-carboxylic acid methyl ester Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2(CC1)CCN(C3=CC=CC=C3C2)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2(CC1)CCN(C3=CC=CC=C3C2)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N2O5/c1-30-22(27)18-10-11-23(15-18)12-13-24(20-5-3-2-4-17(20)14-23)21(26)16-6-8-19(9-7-16)25(28)29/h2-9,15H,10-14H2,1H3