methyl 2-[[(3S)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(3S)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(3S)-1-oxo-3-phenyl-isochromane-6-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[(3S)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-yl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3S)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carbonyl]amino]benzoate Traditional Name: 2-[[(3S)-1-keto-3-phenyl-isochroman-6-carbonyl]amino]benzoic acid methyl ester Formula: C24H19NO5 MolecularWeight: 401.41136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)O[C@@H](C3)C4=CC=CC=C4

InChI

InChI=1S/C24H19NO5/c1-29-23(27)19-9-5-6-10-20(19)25-22(26)16-11-12-18-17(13-16)14-21(30-24(18)28)15-7-3-2-4-8-15/h2-13,21H,14H2,1H3,(H,25,26)/t21-/m0/s1