4-[(1,3,5,5-tetramethyl-2-oxidanylidene-3,4-dihydro-1-benzazepin-7-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(1,3,5,5-tetramethyl-2-oxidanylidene-3,4-dihydro-1-benzazepin-7-yl)carbonylamino]benzoic acid Openeye Name: 4-[(1,3,5,5-tetramethyl-2-oxo-3,4-dihydro-1-benzazepine-7-carbonyl)amino]benzoic acid CAS Name: 4-[[oxo-(1,3,5,5-tetramethyl-2-oxo-3,4-dihydro-1-benzazepin-7-yl)methyl]amino]benzoic acid IUPAC Name: 4-[(1,3,5,5-tetramethyl-2-oxo-3,4-dihydro-1-benzazepine-7-carbonyl)amino]benzoic acid Traditional Name: 4-[(2-keto-1,3,5,5-tetramethyl-3,4-dihydro-1-benzazepine-7-carbonyl)amino]benzoic acid Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)N(C1=O)C)(C)C

Isomeric SMILES

CC1CC(C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)N(C1=O)C)(C)C

InChI

InChI=1S/C22H24N2O4/c1-13-12-22(2,3)17-11-15(7-10-18(17)24(4)20(13)26)19(25)23-16-8-5-14(6-9-16)21(27)28/h5-11,13H,12H2,1-4H3,(H,23,25)(H,27,28)