methyl 2-methoxy-4-[(5-methylidene-3,4-dihydro-2H-1-benzazepin-1-yl)carbonyl]benzoate

Systemtic Name: methyl 2-methoxy-4-[(5-methylidene-3,4-dihydro-2H-1-benzazepin-1-yl)carbonyl]benzoate Openeye Name: methyl 2-methoxy-4-(5-methylene-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoate CAS Name: 2-methoxy-4-[(5-methylene-3,4-dihydro-2H-1-benzazepin-1-yl)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-4-(5-methylidene-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoate Traditional Name: 2-methoxy-4-(5-methylene-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CCCC(=C)C3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CCCC(=C)C3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H21NO4/c1-14-7-6-12-22(18-9-5-4-8-16(14)18)20(23)15-10-11-17(21(24)26-3)19(13-15)25-2/h4-5,8-11,13H,1,6-7,12H2,2-3H3