ethyl 4-[[4-(4-methylphenyl)-1-oxidanylidene-isochromen-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-(4-methylphenyl)-1-oxidanylidene-isochromen-3-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[1-oxo-4-(p-tolyl)isochromene-3-carbonyl]amino]benzoate CAS Name: 4-[[[4-(4-methylphenyl)-1-oxo-2-benzopyran-3-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-methylphenyl)-1-oxoisochromene-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-keto-4-(p-tolyl)isochromene-3-carbonyl]amino]benzoic acid ethyl ester Formula: C26H21NO5 MolecularWeight: 427.44864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H21NO5/c1-3-31-25(29)18-12-14-19(15-13-18)27-24(28)23-22(17-10-8-16(2)9-11-17)20-6-4-5-7-21(20)26(30)32-23/h4-15H,3H2,1-2H3,(H,27,28)