[4-[(3-methylphenyl)amino]-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(3-methylphenyl)amino]-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate Openeye Name: [2,6-diisopropyl-4-(3-methylanilino)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(3-methylanilino)-2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [4-(3-methylanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,6-diisopropyl-4-(m-toluidino)phenyl] ester Formula: C26H31NO3S MolecularWeight: 437.59424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2C(C)C)NC3=CC=CC(=C3)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2C(C)C)NC3=CC=CC(=C3)C)C(C)C

InChI

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