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

Systemtic Name: [4-[(3-methoxyphenyl)amino]-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate Openeye Name: [2,6-diisopropyl-4-(3-methoxyanilino)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(3-methoxyanilino)-2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [4-(3-methoxyanilino)-2,6-di(propan-2-yl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,6-diisopropyl-4-(m-anisidino)phenyl] ester Formula: C26H31NO4S MolecularWeight: 453.59364

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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)OC)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)OC)C(C)C

InChI

InChI=1S/C26H31NO4S/c1-17(2)24-15-21(27-20-8-7-9-22(14-20)30-6)16-25(18(3)4)26(24)31-32(28,29)23-12-10-19(5)11-13-23/h7-18,27H,1-6H3