2-[(3-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[3-chloro-2-methyl-N-(p-tolylsulfonyl)anilino]acetic acid CAS Name: 2-(3-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetic acid IUPAC Name: 2-(3-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetic acid Traditional Name: 2-(3-chloro-2-methyl-N-tosyl-anilino)acetic acid Formula: C16H16ClNO4S MolecularWeight: 353.82054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C16H16ClNO4S/c1-11-6-8-13(9-7-11)23(21,22)18(10-16(19)20)15-5-3-4-14(17)12(15)2/h3-9H,10H2,1-2H3,(H,19,20)