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

Systemtic Name: methyl 5-methyl-2-[(1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl)carbonylamino]benzoate Openeye Name: methyl 5-methyl-2-[(1-oxo-3-phenyl-isochromane-6-carbonyl)amino]benzoate CAS Name: 5-methyl-2-[[oxo-(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(1-oxo-3-phenyl-3,4-dihydroisochromene-6-carbonyl)amino]benzoate Traditional Name: 2-[(1-keto-3-phenyl-isochroman-6-carbonyl)amino]-5-methyl-benzoic acid methyl ester Formula: C25H21NO5 MolecularWeight: 415.43794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H21NO5/c1-15-8-11-21(20(12-15)24(28)30-2)26-23(27)17-9-10-19-18(13-17)14-22(31-25(19)29)16-6-4-3-5-7-16/h3-13,22H,14H2,1-2H3,(H,26,27)