[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-acetamidobenzoate

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-acetamidobenzoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C20H21NO4/c1-4-15-8-10-16(11-9-15)19(23)13(2)25-20(24)17-6-5-7-18(12-17)21-14(3)22/h5-13H,4H2,1-3H3,(H,21,22)