2-[4-[3-[(2,3-dimethylphenyl)methylcarbamoyl]phenyl]phenyl]sulfonylethanoic acid

Systemtic Name: 2-[4-[3-[(2,3-dimethylphenyl)methylcarbamoyl]phenyl]phenyl]sulfonylethanoic acid Openeye Name: 2-[4-[3-[(2,3-dimethylphenyl)methylcarbamoyl]phenyl]phenyl]sulfonylacetic acid CAS Name: 2-[4-[3-[[(2,3-dimethylphenyl)methylamino]-oxomethyl]phenyl]phenyl]sulfonylacetic acid IUPAC Name: 2-[4-[3-[(2,3-dimethylphenyl)methylcarbamoyl]phenyl]phenyl]sulfonylacetic acid Traditional Name: 2-[4-[3-[(2,3-dimethylbenzyl)carbamoyl]phenyl]phenyl]sulfonylacetic acid Formula: C24H23NO5S MolecularWeight: 437.50812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CNC(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)CC(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)CNC(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)CC(=O)O)C

InChI

InChI=1S/C24H23NO5S/c1-16-5-3-8-21(17(16)2)14-25-24(28)20-7-4-6-19(13-20)18-9-11-22(12-10-18)31(29,30)15-23(26)27/h3-13H,14-15H2,1-2H3,(H,25,28)(H,26,27)