(3,3-dimethyl-2-oxidanylidene-butyl) 4-methyl-3-(propanoylamino)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-methyl-3-(propanoylamino)benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-methyl-3-(propanoylamino)benzoate CAS Name: 4-methyl-3-(1-oxopropylamino)benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-methyl-3-(propanoylamino)benzoate Traditional Name: 4-methyl-3-propionamido-benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC(=O)C(C)(C)C)C

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC(=O)C(C)(C)C)C

InChI

InChI=1S/C17H23NO4/c1-6-15(20)18-13-9-12(8-7-11(13)2)16(21)22-10-14(19)17(3,4)5/h7-9H,6,10H2,1-5H3,(H,18,20)