1-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid

Systemtic Name: 1-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid Openeye Name: 1-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid CAS Name: 1-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid IUPAC Name: 1-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid Traditional Name: 1-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid Formula: C31H36N2O6S2 MolecularWeight: 596.75734

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)C3=C(C=CC4=C3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)C3=C(C=CC4=C3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C31H36N2O6S2/c1-5-32(6-2)25-15-9-23(10-16-25)30(24-11-17-26(18-12-24)33(7-3)8-4)31-28-21-27(40(34,35)36)19-13-22(28)14-20-29(31)41(37,38)39/h9-21,30H,5-8H2,1-4H3,(H,34,35,36)(H,37,38,39)