4-[bis[4-(diethylamino)phenyl]methyl]-N,N-diethyl-aniline; 6-oxidanylnaphthalene-2-sulfonic acid

Systemtic Name: 4-[bis[4-(diethylamino)phenyl]methyl]-N,N-diethyl-aniline; 6-oxidanylnaphthalene-2-sulfonic acid Openeye Name: 4-[bis[4-(diethylamino)phenyl]methyl]-N,N-diethyl-aniline; 6-hydroxynaphthalene-2-sulfonic acid CAS Name: 4-[bis[4-(diethylamino)phenyl]methyl]-N,N-diethylaniline; 6-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 4-[bis[4-(diethylamino)phenyl]methyl]-N,N-diethylaniline; 6-hydroxynaphthalene-2-sulfonic acid Traditional Name: [4-[bis[4-(diethylamino)phenyl]methyl]phenyl]-diethyl-amine; 6-hydroxynaphthalene-2-sulfonic acid Formula: C41H51N3O4S MolecularWeight: 681.92634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC.C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C=C1O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC.C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C=C1O

InChI

InChI=1S/C31H43N3.C10H8O4S/c1-7-32(8-2)28-19-13-25(14-20-28)31(26-15-21-29(22-16-26)33(9-3)10-4)27-17-23-30(24-18-27)34(11-5)12-6;11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9/h13-24,31H,7-12H2,1-6H3;1-6,11H,(H,12,13,14)