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

Systemtic Name: 2-[4-[3-[(3-methylphenyl)methylcarbamoyl]phenyl]phenyl]sulfonylethanoic acid Openeye Name: 2-[4-[3-(m-tolylmethylcarbamoyl)phenyl]phenyl]sulfonylacetic acid CAS Name: 2-[4-[3-[[(3-methylphenyl)methylamino]-oxomethyl]phenyl]phenyl]sulfonylacetic acid IUPAC Name: 2-[4-[3-[(3-methylphenyl)methylcarbamoyl]phenyl]phenyl]sulfonylacetic acid Traditional Name: 2-[4-[3-[(3-methylbenzyl)carbamoyl]phenyl]phenyl]sulfonylacetic acid Formula: C23H21NO5S MolecularWeight: 423.48154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21NO5S/c1-16-4-2-5-17(12-16)14-24-23(27)20-7-3-6-19(13-20)18-8-10-21(11-9-18)30(28,29)15-22(25)26/h2-13H,14-15H2,1H3,(H,24,27)(H,25,26)