[4-[(4-methylphenyl)amino]-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(4-methylphenyl)amino]-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate Openeye Name: [2,6-diisopropyl-4-(4-methylanilino)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [4-(4-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,6-diisopropyl-4-(p-toluidino)phenyl] ester Formula: C26H31NO3S MolecularWeight: 437.59424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC(=C(C(=C2)C(C)C)OS(=O)(=O)C3=CC=C(C=C3)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC(=C(C(=C2)C(C)C)OS(=O)(=O)C3=CC=C(C=C3)C)C(C)C

InChI

InChI=1S/C26H31NO3S/c1-17(2)24-15-22(27-21-11-7-19(5)8-12-21)16-25(18(3)4)26(24)30-31(28,29)23-13-9-20(6)10-14-23/h7-18,27H,1-6H3