propan-2-yl 3-(2-chlorophenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-chlorophenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]propanoate Openeye Name: isopropyl 3-(2-chlorophenyl)-3-[3-(p-tolylsulfonyl)propanoylamino]propanoate CAS Name: 3-(2-chlorophenyl)-3-[[3-(4-methylphenyl)sulfonyl-1-oxopropyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-chlorophenyl)-3-[3-(4-methylphenyl)sulfonylpropanoylamino]propanoate Traditional Name: 3-(2-chlorophenyl)-3-(3-tosylpropanoylamino)propionic acid isopropyl ester Formula: C22H26ClNO5S MolecularWeight: 451.96354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2Cl

InChI

InChI=1S/C22H26ClNO5S/c1-15(2)29-22(26)14-20(18-6-4-5-7-19(18)23)24-21(25)12-13-30(27,28)17-10-8-16(3)9-11-17/h4-11,15,20H,12-14H2,1-3H3,(H,24,25)