methyl 3-(6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1,2-benzoxazol-3-yl)propanoate

Systemtic Name: methyl 3-(6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1,2-benzoxazol-3-yl)propanoate Openeye Name: methyl 3-(6,6-dimethyl-4-oxo-5,7-dihydro-1,2-benzoxazol-3-yl)propanoate CAS Name: 3-(6,6-dimethyl-4-oxo-5,7-dihydro-1,2-benzoxazol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(6,6-dimethyl-4-oxo-5,7-dihydro-1,2-benzoxazol-3-yl)propanoate Traditional Name: 3-(4-keto-6,6-dimethyl-5,7-dihydroindoxazen-3-yl)propionic acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NO2)CCC(=O)OC)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NO2)CCC(=O)OC)C

InChI

InChI=1S/C13H17NO4/c1-13(2)6-9(15)12-8(4-5-11(16)17-3)14-18-10(12)7-13/h4-7H2,1-3H3