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

Systemtic Name: 8-methoxy-4-oxidanylidene-2,5-dihydro-1H-3-benzazepine-3-carboxylic acid Openeye Name: 8-methoxy-4-oxo-2,5-dihydro-1H-3-benzazepine-3-carboxylic acid CAS Name: 8-methoxy-4-oxo-2,5-dihydro-1H-3-benzazepine-3-carboxylic acid IUPAC Name: 8-methoxy-4-oxo-2,5-dihydro-1H-3-benzazepine-3-carboxylic acid Traditional Name: 4-keto-8-methoxy-2,5-dihydro-1H-3-benzazepine-3-carboxylic acid Formula: C12H13NO4 MolecularWeight: 235.23592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(=O)N(CC2)C(=O)O)C=C1

Isomeric SMILES

COC1=CC2=C(CC(=O)N(CC2)C(=O)O)C=C1

InChI

InChI=1S/C12H13NO4/c1-17-10-3-2-8-7-11(14)13(12(15)16)5-4-9(8)6-10/h2-3,6H,4-5,7H2,1H3,(H,15,16)