[2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate

Systemtic Name: [2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 3-acetamidobenzoate Openeye Name: [2-(2,5-diethylphenyl)-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [2-(2,5-diethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-diethylphenyl)-2-oxoethyl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-(2,5-diethylphenyl)-2-keto-ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4/c1-4-15-9-10-16(5-2)19(11-15)20(24)13-26-21(25)17-7-6-8-18(12-17)22-14(3)23/h6-12H,4-5,13H2,1-3H3,(H,22,23)