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

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-(2-phenylethanoylamino)propanoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CCNC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)CCNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C22H25NO4/c1-3-17-9-11-19(12-10-17)22(26)16(2)27-21(25)13-14-23-20(24)15-18-7-5-4-6-8-18/h4-12,16H,3,13-15H2,1-2H3,(H,23,24)