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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)[C@H]2CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C19H17NO5/c1-24-18(22)13-8-6-12(7-9-13)11-20-17(21)16-10-14-4-2-3-5-15(14)19(23)25-16/h2-9,16H,10-11H2,1H3,(H,20,21)/t16-/m1/s1