4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonic acid

Systemtic Name: 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonic acid Openeye Name: 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonic acid CAS Name: 4-[bis(4-dimethylaminophenyl)methyl]-1-naphthalenesulfonic acid IUPAC Name: 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonic acid Traditional Name: 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonic acid Formula: C27H28N2O3S MolecularWeight: 460.58782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C4=CC=CC=C43)S(=O)(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C4=CC=CC=C43)S(=O)(=O)O

InChI

InChI=1S/C27H28N2O3S/c1-28(2)21-13-9-19(10-14-21)27(20-11-15-22(16-12-20)29(3)4)25-17-18-26(33(30,31)32)24-8-6-5-7-23(24)25/h5-18,27H,1-4H3,(H,30,31,32)