[(2R)-1-[4-(2,2-dimethylpropanoylamino)phenyl]-1-oxidanylidene-propan-2-yl] 3-methylbenzoate

Systemtic Name: [(2R)-1-[4-(2,2-dimethylpropanoylamino)phenyl]-1-oxidanylidene-propan-2-yl] 3-methylbenzoate Openeye Name: [(1R)-2-[4-(2,2-dimethylpropanoylamino)phenyl]-1-methyl-2-oxo-ethyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [(2R)-1-[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[4-(2,2-dimethylpropanoylamino)phenyl]-1-oxopropan-2-yl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [(1R)-2-keto-1-methyl-2-[4-(pivaloylamino)phenyl]ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC(C)C(=O)C2=CC=C(C=C2)NC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)O[C@H](C)C(=O)C2=CC=C(C=C2)NC(=O)C(C)(C)C

InChI

InChI=1S/C22H25NO4/c1-14-7-6-8-17(13-14)20(25)27-15(2)19(24)16-9-11-18(12-10-16)23-21(26)22(3,4)5/h6-13,15H,1-5H3,(H,23,26)/t15-/m1/s1