2-(2-quinolin-8-ylbenzimidazol-1-yl)ethyl 5-(dimethylamino)naphthalene-1-sulfonate

Systemtic Name: 2-(2-quinolin-8-ylbenzimidazol-1-yl)ethyl 5-(dimethylamino)naphthalene-1-sulfonate Openeye Name: 2-[2-(8-quinolyl)benzimidazol-1-yl]ethyl 5-(dimethylamino)naphthalene-1-sulfonate CAS Name: 5-(dimethylamino)-1-naphthalenesulfonic acid 2-[2-(8-quinolinyl)-1-benzimidazolyl]ethyl ester IUPAC Name: 2-(2-quinolin-8-ylbenzimidazol-1-yl)ethyl 5-(dimethylamino)naphthalene-1-sulfonate Traditional Name: 5-(dimethylamino)naphthalene-1-sulfonic acid 2-[2-(8-quinolyl)benzimidazol-1-yl]ethyl ester Formula: C30H26N4O3S MolecularWeight: 522.61744

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)OCCN3C4=CC=CC=C4N=C3C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)OCCN3C4=CC=CC=C4N=C3C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C30H26N4O3S/c1-33(2)26-16-6-12-23-22(26)11-7-17-28(23)38(35,36)37-20-19-34-27-15-4-3-14-25(27)32-30(34)24-13-5-9-21-10-8-18-31-29(21)24/h3-18H,19-20H2,1-2H3