[(2R)-1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate

Systemtic Name: [(2R)-1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate Openeye Name: [(1R)-2-(4-carbamoylanilino)-1-methyl-2-oxo-ethyl] 4-(4-chloro-2-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-2-methylphenoxy)butanoic acid [(2R)-1-(4-carbamoylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-carbamoylanilino)-1-oxopropan-2-yl] 4-(4-chloro-2-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-2-methyl-phenoxy)butyric acid [(1R)-2-(4-carbamoylanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)OC(C)C(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C21H23ClN2O5/c1-13-12-16(22)7-10-18(13)28-11-3-4-19(25)29-14(2)21(27)24-17-8-5-15(6-9-17)20(23)26/h5-10,12,14H,3-4,11H2,1-2H3,(H2,23,26)(H,24,27)/t14-/m1/s1