[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate

Systemtic Name: [(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(4-chloranyl-3-methyl-phenoxy)butanoate Openeye Name: [(1R)-2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl] 4-(4-chloro-3-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3-methylphenoxy)butanoic acid [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl] 4-(4-chloro-3-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-3-methyl-phenoxy)butyric acid [(1R)-2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H25ClN2O5 MolecularWeight: 432.8973

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClN2O5/c1-14-13-19(10-11-20(14)23)29-12-4-5-21(27)30-15(2)22(28)25-18-8-6-17(7-9-18)24-16(3)26/h6-11,13,15H,4-5,12H2,1-3H3,(H,24,26)(H,25,28)/t15-/m1/s1