dimethyl 5-[[(2R)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(2R)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(2R)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(2R)-2-(4-chlorophenyl)-3-methyl-1-oxobutyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(2R)-2-(4-chlorophenyl)-3-methylbutanoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(2R)-2-(4-chlorophenyl)-3-methyl-butanoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)Cl)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H22ClNO5/c1-12(2)18(13-5-7-16(22)8-6-13)19(24)23-17-10-14(20(25)27-3)9-15(11-17)21(26)28-4/h5-12,18H,1-4H3,(H,23,24)/t18-/m1/s1