1,7-dimethyl-4-pentadecyl-4aH-quinolin-1-ium-2-thione

Systemtic Name: 1,7-dimethyl-4-pentadecyl-4aH-quinolin-1-ium-2-thione Openeye Name: 1,7-dimethyl-4-pentadecyl-4aH-quinolin-1-ium-2-thione CAS Name: 1,7-dimethyl-4-pentadecyl-4aH-quinolin-1-ium-2-thione IUPAC Name: 1,7-dimethyl-4-pentadecyl-4aH-quinolin-1-ium-2-thione Traditional Name: 1,7-dimethyl-4-pentadecyl-4aH-quinolin-1-ium-2-thione Formula: C26H42NS+ MolecularWeight: 400.68338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=S)[N+](=C2C1C=CC(=C2)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=S)[N+](=C2C1C=CC(=C2)C)C

InChI

InChI=1S/C26H42NS/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-21-26(28)27(3)25-20-22(2)18-19-24(23)25/h18-21,24H,4-17H2,1-3H3/q+1