[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(phenylcarbamoylamino)propanoate

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(phenylcarbamoylamino)propanoate Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(phenylcarbamoylamino)propanoate CAS Name: 3-[[anilino(oxo)methyl]amino]propanoic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(phenylcarbamoylamino)propanoate Traditional Name: 3-(phenylcarbamoylamino)propionic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O4/c1-2-15-8-10-16(11-9-15)20-24-18(29-25-20)14-28-19(26)12-13-22-21(27)23-17-6-4-3-5-7-17/h3-11H,2,12-14H2,1H3,(H2,22,23,27)