2-[2-[[(4-ethanoylphenyl)sulfonylamino]methyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[[(4-ethanoylphenyl)sulfonylamino]methyl]phenyl]benzoic acid Openeye Name: 2-[2-[[(4-acetylphenyl)sulfonylamino]methyl]phenyl]benzoic acid CAS Name: 2-[2-[[(4-acetylphenyl)sulfonylamino]methyl]phenyl]benzoic acid IUPAC Name: 2-[2-[[(4-acetylphenyl)sulfonylamino]methyl]phenyl]benzoic acid Traditional Name: 2-[2-[[(4-acetylphenyl)sulfonylamino]methyl]phenyl]benzoic acid Formula: C22H19NO5S MolecularWeight: 409.45496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C22H19NO5S/c1-15(24)16-10-12-18(13-11-16)29(27,28)23-14-17-6-2-3-7-19(17)20-8-4-5-9-21(20)22(25)26/h2-13,23H,14H2,1H3,(H,25,26)