2-(3-methoxy-3-oxidanylidene-propyl)-3-oxidanylidene-4,5-dihydro-1H-2-benzazepine-8-carboxylic acid

Systemtic Name: 2-(3-methoxy-3-oxidanylidene-propyl)-3-oxidanylidene-4,5-dihydro-1H-2-benzazepine-8-carboxylic acid Openeye Name: 2-(3-methoxy-3-oxo-propyl)-3-oxo-4,5-dihydro-1H-2-benzazepine-8-carboxylic acid CAS Name: 2-(3-methoxy-3-oxopropyl)-3-oxo-4,5-dihydro-1H-2-benzazepine-8-carboxylic acid IUPAC Name: 2-(3-methoxy-3-oxopropyl)-3-oxo-4,5-dihydro-1H-2-benzazepine-8-carboxylic acid Traditional Name: 3-keto-2-(3-keto-3-methoxy-propyl)-4,5-dihydro-1H-2-benzazepine-8-carboxylic acid Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1CC2=C(CCC1=O)C=CC(=C2)C(=O)O

Isomeric SMILES

COC(=O)CCN1CC2=C(CCC1=O)C=CC(=C2)C(=O)O

InChI

InChI=1S/C15H17NO5/c1-21-14(18)6-7-16-9-12-8-11(15(19)20)3-2-10(12)4-5-13(16)17/h2-3,8H,4-7,9H2,1H3,(H,19,20)