[(1R)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate

Systemtic Name: [(1R)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate Openeye Name: [(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl] 4-(4-chloro-3-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3-methylphenoxy)butanoic acid [(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] 4-(4-chloro-3-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-3-methyl-phenoxy)butyric acid [(1R)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl] ester Formula: C21H23ClN2O5 MolecularWeight: 418.87072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)OC(C2=CC=CC=C2)C(=O)NC(=O)NC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)O[C@H](C2=CC=CC=C2)C(=O)NC(=O)NC)Cl

InChI

InChI=1S/C21H23ClN2O5/c1-14-13-16(10-11-17(14)22)28-12-6-9-18(25)29-19(15-7-4-3-5-8-15)20(26)24-21(27)23-2/h3-5,7-8,10-11,13,19H,6,9,12H2,1-2H3,(H2,23,24,26,27)/t19-/m1/s1