[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 3-benzamidobutanoate

Systemtic Name: [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 3-benzamidobutanoate Openeye Name: [3-(4-chlorophenyl)isoxazol-5-yl]methyl 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [3-(4-chlorophenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [3-(4-chlorophenyl)isoxazol-5-yl]methyl ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC1=CC(=NO1)C2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)OCC1=CC(=NO1)C2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19ClN2O4/c1-14(23-21(26)16-5-3-2-4-6-16)11-20(25)27-13-18-12-19(24-28-18)15-7-9-17(22)10-8-15/h2-10,12,14H,11,13H2,1H3,(H,23,26)