[2,6-bis(azanyl)-4-(dihexylamino)pyridin-1-ium-1-yl] hydrogen sulfate

Systemtic Name: [2,6-bis(azanyl)-4-(dihexylamino)pyridin-1-ium-1-yl] hydrogen sulfate Openeye Name: [2,6-diamino-4-(dihexylamino)pyridin-1-ium-1-yl] hydrogen sulfate CAS Name: sulfuric acid [2,6-diamino-4-(dihexylamino)-1-pyridin-1-iumyl] ester IUPAC Name: [2,6-diamino-4-(dihexylamino)pyridin-1-ium-1-yl] hydrogen sulfate Traditional Name: sulfuric acid [2,6-diamino-4-(dihexylamino)pyridin-1-ium-1-yl] ester Formula: C17H33N4O4S+ MolecularWeight: 389.53332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=CC(=[N+](C(=C1)N)OS(=O)(=O)O)N

Isomeric SMILES

CCCCCCN(CCCCCC)C1=CC(=[N+](C(=C1)N)OS(=O)(=O)O)N

InChI

InChI=1S/C17H32N4O4S/c1-3-5-7-9-11-20(12-10-8-6-4-2)15-13-16(18)21(17(19)14-15)25-26(22,23)24/h13-14H,3-12H2,1-2H3,(H4,18,19,22,23,24)/p+1