3-[methyl(methylsulfonyl)amino]-5-(1-phenylethylcarbamoyl)benzoic acid

Systemtic Name: 3-[methyl(methylsulfonyl)amino]-5-(1-phenylethylcarbamoyl)benzoic acid Openeye Name: 3-[methyl(methylsulfonyl)amino]-5-(1-phenylethylcarbamoyl)benzoic acid CAS Name: 3-[methyl(methylsulfonyl)amino]-5-[oxo-(1-phenylethylamino)methyl]benzoic acid IUPAC Name: 3-[methyl(methylsulfonyl)amino]-5-(1-phenylethylcarbamoyl)benzoic acid Traditional Name: 3-[mesyl(methyl)amino]-5-(1-phenylethylcarbamoyl)benzoic acid Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)N(C)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)N(C)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C18H20N2O5S/c1-12(13-7-5-4-6-8-13)19-17(21)14-9-15(18(22)23)11-16(10-14)20(2)26(3,24)25/h4-12H,1-3H3,(H,19,21)(H,22,23)