4-[Bis[4-[bis(phenylmethyl)amino]phenyl]methyl]-1,3-benzenedisulfonic acid

CAS Registry Number®

93982-50-4

CAS Name

4-[Bis[4-[bis(phenylmethyl)amino]phenyl]methyl]-1,3-benzenedisulfonic acid

Molecular Formula

C47H42N2O6S2

Molecular Mass

794.98

Cite this Page

4-[Bis[4-[bis(phenylmethyl)amino]phenyl]methyl]-1,3-benzenedisulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93982-50-4 (retrieved 2024-12-23) (CAS RN: 93982-50-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C47H42N2O6S2/c50-56(51,52)44-29-30-45(46(31-44)57(53,54)55)47(40-21-25-42(26-22-40)48(32-36-13-5-1-6-14-36)33-37-15-7-2-8-16-37)41-23-27-43(28-24-41)49(34-38-17-9-3-10-18-38)35-39-19-11-4-12-20-39/h1-31,47H,32-35H2,(H,50,51,52)(H,53,54,55)

InChIKey

InChIKey=GTBGZMMEAUYMQS-UHFFFAOYSA-N

SMILES

C(C1=C(S(=O)(=O)O)C=C(S(=O)(=O)O)C=C1)(C2=CC=C(N(CC3=CC=CC=C3)CC4=CC=CC=C4)C=C2)C5=CC=C(N(CC6=CC=CC=C6)CC7=CC=CC=C7)C=C5

Canonical SMILES

O=S(=O)(O)C1=CC=C(C(=C1)S(=O)(=O)O)C(C2=CC=C(C=C2)N(CC=3C=CC=CC3)CC=4C=CC=CC4)C5=CC=C(C=C5)N(CC=6C=CC=CC6)CC=7C=CC=CC7

Other Names for this Substance

  • 1,3-Benzenedisulfonic acid, 4-[bis[4-[bis(phenylmethyl)amino]phenyl]methyl]-
  • 4-[Bis[4-[bis(phenylmethyl)amino]phenyl]methyl]-1,3-benzenedisulfonic acid

CAS INSIGHTSTM
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