methyl 4,5-dimethoxy-2-[[(3S)-3-(4-methylphenyl)-1-oxidanylidene-3,4-dihydroisochromen-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[(3S)-3-(4-methylphenyl)-1-oxidanylidene-3,4-dihydroisochromen-6-yl]carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[(3S)-1-oxo-3-(p-tolyl)isochromane-6-carbonyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[[(3S)-3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[(3S)-3-(4-methylphenyl)-1-oxo-3,4-dihydroisochromene-6-carbonyl]amino]benzoate Traditional Name: 2-[[(3S)-1-keto-3-(p-tolyl)isochroman-6-carbonyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C27H25NO7 MolecularWeight: 475.4899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC3=C(C=CC(=C3)C(=O)NC4=CC(=C(C=C4C(=O)OC)OC)OC)C(=O)O2

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2CC3=C(C=CC(=C3)C(=O)NC4=CC(=C(C=C4C(=O)OC)OC)OC)C(=O)O2

InChI

InChI=1S/C27H25NO7/c1-15-5-7-16(8-6-15)22-12-18-11-17(9-10-19(18)27(31)35-22)25(29)28-21-14-24(33-3)23(32-2)13-20(21)26(30)34-4/h5-11,13-14,22H,12H2,1-4H3,(H,28,29)/t22-/m0/s1