4-[(1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-8-yl)carbamoyl]benzoic acid

Systemtic Name: 4-[(1-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-8-yl)carbamoyl]benzoic acid Openeye Name: 4-[(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-8-yl)carbamoyl]benzoic acid CAS Name: 4-[[(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-8-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 4-[(1-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-8-yl)carbamoyl]benzoic acid Traditional Name: 4-[(2-keto-1-methyl-4,5-dihydro-3H-1-benzazepin-8-yl)carbamoyl]benzoic acid Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCCC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1C(=O)CCCC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H18N2O4/c1-21-16-11-15(10-9-12(16)3-2-4-17(21)22)20-18(23)13-5-7-14(8-6-13)19(24)25/h5-11H,2-4H2,1H3,(H,20,23)(H,24,25)