3-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]propanoate

Systemtic Name: 3-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]propanoate Openeye Name: 3-[(4-chlorophenyl)methyl-(p-tolylsulfonyl)amino]propanoate CAS Name: 3-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]propanoate IUPAC Name: 3-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-chlorobenzyl)-tosyl-amino]propionate Formula: C17H17ClNO4S- MolecularWeight: 366.83918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)[O-])CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)[O-])CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H18ClNO4S/c1-13-2-8-16(9-3-13)24(22,23)19(11-10-17(20)21)12-14-4-6-15(18)7-5-14/h2-9H,10-12H2,1H3,(H,20,21)/p-1