3-methyl-4-[(1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl)carbonylamino]benzoic acid

Systemtic Name: 3-methyl-4-[(1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl)carbonylamino]benzoic acid Openeye Name: 3-methyl-4-[(1-oxo-3-phenyl-isochromane-6-carbonyl)amino]benzoic acid CAS Name: 3-methyl-4-[[oxo-(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-yl)methyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[(1-oxo-3-phenyl-3,4-dihydroisochromene-6-carbonyl)amino]benzoic acid Traditional Name: 4-[(1-keto-3-phenyl-isochroman-6-carbonyl)amino]-3-methyl-benzoic acid Formula: C24H19NO5 MolecularWeight: 401.41136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

InChI

InChI=1S/C24H19NO5/c1-14-11-17(23(27)28)8-10-20(14)25-22(26)16-7-9-19-18(12-16)13-21(30-24(19)29)15-5-3-2-4-6-15/h2-12,21H,13H2,1H3,(H,25,26)(H,27,28)