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

Systemtic Name: methyl 2-[(1-oxidanylidene-6-propan-2-yl-3,4-dihydroisochromen-3-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(6-isopropyl-1-oxo-isochromane-3-carbonyl)amino]benzoate CAS Name: 2-[[oxo-(1-oxo-6-propan-2-yl-3,4-dihydro-1H-2-benzopyran-3-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-oxo-6-propan-2-yl-3,4-dihydroisochromene-3-carbonyl)amino]benzoate Traditional Name: 2-[(6-isopropyl-1-keto-isochroman-3-carbonyl)amino]benzoic acid methyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H21NO5/c1-12(2)13-8-9-15-14(10-13)11-18(27-21(15)25)19(23)22-17-7-5-4-6-16(17)20(24)26-3/h4-10,12,18H,11H2,1-3H3,(H,22,23)