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

Systemtic Name: 4-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid Openeye Name: 4-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid CAS Name: 4-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid IUPAC Name: 4-[bis[4-(diethylamino)phenyl]methyl]naphthalene-2,7-disulfonic acid Traditional Name: 4-[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=C4C=CC(=CC4=CC(=C3)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=C4C=CC(=CC4=CC(=C3)S(=O)(=O)O)S(=O)(=O)O

InChI

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