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

Systemtic Name: 2-methoxy-4-[(5-methylidene-3,4-dihydro-2H-1-benzazepin-1-yl)carbonyl]benzoic acid Openeye Name: 2-methoxy-4-(5-methylene-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoic acid CAS Name: 2-methoxy-4-[(5-methylene-3,4-dihydro-2H-1-benzazepin-1-yl)-oxomethyl]benzoic acid IUPAC Name: 2-methoxy-4-(5-methylidene-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoic acid Traditional Name: 2-methoxy-4-(5-methylene-3,4-dihydro-2H-1-benzazepine-1-carbonyl)benzoic acid Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO4/c1-13-6-5-11-21(17-8-4-3-7-15(13)17)19(22)14-9-10-16(20(23)24)18(12-14)25-2/h3-4,7-10,12H,1,5-6,11H2,2H3,(H,23,24)