dimethyl 2-[(7-methyl-1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(7-methyl-1-oxidanylidene-3,4-dihydroisochromen-3-yl)carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(7-methyl-1-oxo-isochromane-3-carbonyl)amino]benzene-1,4-dicarboxylate CAS Name: 2-[[(7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(7-methyl-1-oxo-3,4-dihydroisochromene-3-carbonyl)amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(1-keto-7-methyl-isochroman-3-carbonyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(OC2=O)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC)C=C1

Isomeric SMILES

CC1=CC2=C(CC(OC2=O)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC)C=C1

InChI

InChI=1S/C21H19NO7/c1-11-4-5-12-10-17(29-21(26)15(12)8-11)18(23)22-16-9-13(19(24)27-2)6-7-14(16)20(25)28-3/h4-9,17H,10H2,1-3H3,(H,22,23)