methyl 2-methoxy-4-[(2-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepin-6-yl)carbonyl]benzoate

Systemtic Name: methyl 2-methoxy-4-[(2-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepin-6-yl)carbonyl]benzoate Openeye Name: methyl 2-methoxy-4-(2-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepine-6-carbonyl)benzoate CAS Name: 2-methoxy-4-[(2-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepin-6-yl)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-4-(2-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepine-6-carbonyl)benzoate Traditional Name: 2-methoxy-4-(2-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepine-6-carbonyl)benzoic acid methyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1)CCN(C3=CC=CC=C32)C(=O)C4=CC(=C(C=C4)C(=O)OC)OC

Isomeric SMILES

CC1=NC2=C(N1)CCN(C3=CC=CC=C32)C(=O)C4=CC(=C(C=C4)C(=O)OC)OC

InChI

InChI=1S/C22H21N3O4/c1-13-23-17-10-11-25(18-7-5-4-6-15(18)20(17)24-13)21(26)14-8-9-16(22(27)29-3)19(12-14)28-2/h4-9,12H,10-11H2,1-3H3,(H,23,24)