sodium 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonate

Systemtic Name: sodium 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonate Openeye Name: sodium 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonate CAS Name: sodium 4-[bis(4-dimethylaminophenyl)methyl]-1-naphthalenesulfonate IUPAC Name: sodium 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonate Traditional Name: sodium 4-[bis(4-dimethylaminophenyl)methyl]naphthalene-1-sulfonate Formula: C27H27N2NaO3S MolecularWeight: 482.56965

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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-].[Na+]

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-].[Na+]

InChI

InChI=1S/C27H28N2O3S.Na/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);/q;+1/p-1