methyl 4-[(1-oxidanylideneisochromen-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(1-oxidanylideneisochromen-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(1-oxoisochromene-3-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(1-oxo-2-benzopyran-3-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-oxoisochromene-3-carbonyl)amino]benzoate Traditional Name: 4-[(1-ketoisochromene-3-carbonyl)amino]benzoic acid methyl ester Formula: C18H13NO5 MolecularWeight: 323.29952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H13NO5/c1-23-17(21)11-6-8-13(9-7-11)19-16(20)15-10-12-4-2-3-5-14(12)18(22)24-15/h2-10H,1H3,(H,19,20)