[3-[(4-dimethylaminophenyl)-phenyl-amino]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [3-[(4-dimethylaminophenyl)-phenyl-amino]phenyl] 4-methylbenzenesulfonate Openeye Name: [3-(N-(4-dimethylaminophenyl)anilino)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(N-(4-dimethylaminophenyl)anilino)phenyl] ester IUPAC Name: [3-(N-(4-dimethylaminophenyl)anilino)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(N-(4-dimethylaminophenyl)anilino)phenyl] ester Formula: C27H26N2O3S MolecularWeight: 458.57194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)N(C3=CC=CC=C3)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)N(C3=CC=CC=C3)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H26N2O3S/c1-21-12-18-27(19-13-21)33(30,31)32-26-11-7-10-25(20-26)29(23-8-5-4-6-9-23)24-16-14-22(15-17-24)28(2)3/h4-20H,1-3H3