2-[2-[(4-phenacylsulfonylphenyl)carbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[(4-phenacylsulfonylphenyl)carbamoyl]phenyl]benzoic acid Openeye Name: 2-[2-[(4-phenacylsulfonylphenyl)carbamoyl]phenyl]benzoic acid CAS Name: 2-[2-[oxo-(4-phenacylsulfonylanilino)methyl]phenyl]benzoic acid IUPAC Name: 2-[2-[(4-phenacylsulfonylphenyl)carbamoyl]phenyl]benzoic acid Traditional Name: 2-[2-[(4-phenacylsulfonylphenyl)carbamoyl]phenyl]benzoic acid Formula: C28H21NO6S MolecularWeight: 499.53444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C28H21NO6S/c30-26(19-8-2-1-3-9-19)18-36(34,35)21-16-14-20(15-17-21)29-27(31)24-12-6-4-10-22(24)23-11-5-7-13-25(23)28(32)33/h1-17H,18H2,(H,29,31)(H,32,33)