2-[(2,4-dichlorophenyl)carbonyl-[(4-methylsulfonylphenyl)methyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(2,4-dichlorophenyl)carbonyl-[(4-methylsulfonylphenyl)methyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[(2,4-dichlorobenzoyl)-[(4-methylsulfonylphenyl)methyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]-[(4-methylsulfonylphenyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(2,4-dichlorobenzoyl)-[(4-methylsulfonylphenyl)methyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(2,4-dichlorobenzoyl)-(4-mesylbenzyl)amino]-3-phenyl-propionic acid Formula: C24H21Cl2NO5S MolecularWeight: 506.39824

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C24H21Cl2NO5S/c1-33(31,32)19-10-7-17(8-11-19)15-27(23(28)20-12-9-18(25)14-21(20)26)22(24(29)30)13-16-5-3-2-4-6-16/h2-12,14,22H,13,15H2,1H3,(H,29,30)