propyl 4-[(1-oxidanylideneisothiochromen-3-yl)carbonylamino]benzoate

Systemtic Name: propyl 4-[(1-oxidanylideneisothiochromen-3-yl)carbonylamino]benzoate Openeye Name: propyl 4-[(1-oxoisothiochromene-3-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(1-oxo-2-benzothiopyran-3-yl)methyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(1-oxoisothiochromene-3-carbonyl)amino]benzoate Traditional Name: 4-[(1-ketoisothiochromene-3-carbonyl)amino]benzoic acid propyl ester Formula: C20H17NO4S MolecularWeight: 367.41828

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=O)S2

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=O)S2

InChI

InChI=1S/C20H17NO4S/c1-2-11-25-19(23)13-7-9-15(10-8-13)21-18(22)17-12-14-5-3-4-6-16(14)20(24)26-17/h3-10,12H,2,11H2,1H3,(H,21,22)