(4E)-2-(3,4-dimethoxyphenyl)-4-(hexadecylsulfonylhydrazinylidene)-1-methyl-quinoline-6-sulfonic acid

Systemtic Name: (4E)-2-(3,4-dimethoxyphenyl)-4-(hexadecylsulfonylhydrazinylidene)-1-methyl-quinoline-6-sulfonic acid Openeye Name: (4E)-2-(3,4-dimethoxyphenyl)-4-(hexadecylsulfonylhydrazono)-1-methyl-quinoline-6-sulfonic acid CAS Name: (4E)-2-(3,4-dimethoxyphenyl)-4-(hexadecylsulfonylhydrazinylidene)-1-methyl-6-quinolinesulfonic acid IUPAC Name: (4E)-2-(3,4-dimethoxyphenyl)-4-(hexadecylsulfonylhydrazinylidene)-1-methylquinoline-6-sulfonic acid Traditional Name: (4E)-4-(cetylsulfonylhydrazono)-2-(3,4-dimethoxyphenyl)-1-methyl-quinoline-6-sulfonic acid Formula: C34H51N3O7S2 MolecularWeight: 677.91464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)NN=C1C=C(N(C2=C1C=C(C=C2)S(=O)(=O)O)C)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)N/N=C/1\C=C(N(C2=C1C=C(C=C2)S(=O)(=O)O)C)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C34H51N3O7S2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-45(38,39)36-35-30-26-32(27-19-22-33(43-3)34(24-27)44-4)37(2)31-21-20-28(25-29(30)31)46(40,41)42/h19-22,24-26,36H,5-18,23H2,1-4H3,(H,40,41,42)/b35-30+