methyl 4-[(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-2-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(3,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-2-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(3,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-2-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carbonyl)amino]benzoate Traditional Name: 4-[(4-keto-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carbonyl)amino]benzoic acid methyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21NO5/c1-11-16-14(22)9-20(2,3)10-15(16)26-17(11)18(23)21-13-7-5-12(6-8-13)19(24)25-4/h5-8H,9-10H2,1-4H3,(H,21,23)