methyl 3-[(3,4-dichlorophenyl)-(4-methylphenyl)sulfonyl-amino]butanoate

Systemtic Name: methyl 3-[(3,4-dichlorophenyl)-(4-methylphenyl)sulfonyl-amino]butanoate Openeye Name: methyl 3-[3,4-dichloro-N-(p-tolylsulfonyl)anilino]butanoate CAS Name: 3-(3,4-dichloro-N-(4-methylphenyl)sulfonylanilino)butanoic acid methyl ester IUPAC Name: methyl 3-(3,4-dichloro-N-(4-methylphenyl)sulfonylanilino)butanoate Traditional Name: 3-(3,4-dichloro-N-tosyl-anilino)butyric acid methyl ester Formula: C18H19Cl2NO4S MolecularWeight: 416.31876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19Cl2NO4S/c1-12-4-7-15(8-5-12)26(23,24)21(13(2)10-18(22)25-3)14-6-9-16(19)17(20)11-14/h4-9,11,13H,10H2,1-3H3