2-methoxy-4-[(5-oxidanylidene-3,4-dihydro-2H-1-benzazepin-1-yl)carbonyl]benzoic acid

Systemtic Name: 2-methoxy-4-[(5-oxidanylidene-3,4-dihydro-2H-1-benzazepin-1-yl)carbonyl]benzoic acid Openeye Name: 2-methoxy-4-(5-oxo-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoic acid CAS Name: 2-methoxy-4-[oxo-(5-oxo-3,4-dihydro-2H-1-benzazepin-1-yl)methyl]benzoic acid IUPAC Name: 2-methoxy-4-(5-oxo-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoic acid Traditional Name: 4-(5-keto-3,4-dihydro-2H-1-benzazepine-1-carbonyl)-2-methoxy-benzoic acid Formula: C19H17NO5 MolecularWeight: 339.34198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO5/c1-25-17-11-12(8-9-14(17)19(23)24)18(22)20-10-4-7-16(21)13-5-2-3-6-15(13)20/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,23,24)