ethyl 4-[(1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(1-oxoisochromane-3-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-oxo-3,4-dihydroisochromene-3-carbonyl)amino]benzoate Traditional Name: 4-[(1-ketoisochroman-3-carbonyl)amino]benzoic acid ethyl ester Formula: C19H17NO5 MolecularWeight: 339.34198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C19H17NO5/c1-2-24-18(22)12-7-9-14(10-8-12)20-17(21)16-11-13-5-3-4-6-15(13)19(23)25-16/h3-10,16H,2,11H2,1H3,(H,20,21)