methyl 3-(4-chlorophenyl)-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]propanoate

Systemtic Name: methyl 3-(4-chlorophenyl)-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]propanoate Openeye Name: methyl 3-(4-chlorophenyl)-3-[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]propanoate CAS Name: 3-(4-chlorophenyl)-3-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-chlorophenyl)-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]propanoate Traditional Name: 3-(4-chlorophenyl)-3-[3-(4-piperidinosulfonylphenyl)propanoylamino]propionic acid methyl ester Formula: C24H29ClN2O5S MolecularWeight: 493.01546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)Cl)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)CC(C1=CC=C(C=C1)Cl)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C24H29ClN2O5S/c1-32-24(29)17-22(19-8-10-20(25)11-9-19)26-23(28)14-7-18-5-12-21(13-6-18)33(30,31)27-15-3-2-4-16-27/h5-6,8-13,22H,2-4,7,14-17H2,1H3,(H,26,28)