2-methyl-4-phenethyl-6-phenyl-3-(phenylsulfonylamino)benzoic acid

Systemtic Name: 2-methyl-4-phenethyl-6-phenyl-3-(phenylsulfonylamino)benzoic acid Openeye Name: 3-(benzenesulfonamido)-2-methyl-4-phenethyl-6-phenyl-benzoic acid CAS Name: 3-(benzenesulfonamido)-2-methyl-4-phenethyl-6-phenylbenzoic acid IUPAC Name: 3-(benzenesulfonamido)-2-methyl-4-phenethyl-6-phenylbenzoic acid Traditional Name: 3-(benzenesulfonamido)-2-methyl-4-phenethyl-6-phenyl-benzoic acid Formula: C28H25NO4S MolecularWeight: 471.5674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1NS(=O)(=O)C2=CC=CC=C2)CCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C(=CC(=C1NS(=O)(=O)C2=CC=CC=C2)CCC3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H25NO4S/c1-20-26(28(30)31)25(22-13-7-3-8-14-22)19-23(18-17-21-11-5-2-6-12-21)27(20)29-34(32,33)24-15-9-4-10-16-24/h2-16,19,29H,17-18H2,1H3,(H,30,31)