[2,6-bis(azanyl)-4-(2,3-dimethylpyrrolidin-1-yl)pyridin-1-ium-1-yl] hydrogen sulfate

Systemtic Name: [2,6-bis(azanyl)-4-(2,3-dimethylpyrrolidin-1-yl)pyridin-1-ium-1-yl] hydrogen sulfate Openeye Name: [2,6-diamino-4-(2,3-dimethylpyrrolidin-1-yl)pyridin-1-ium-1-yl] hydrogen sulfate CAS Name: sulfuric acid [2,6-diamino-4-(2,3-dimethyl-1-pyrrolidinyl)-1-pyridin-1-iumyl] ester IUPAC Name: [2,6-diamino-4-(2,3-dimethylpyrrolidin-1-yl)pyridin-1-ium-1-yl] hydrogen sulfate Traditional Name: sulfuric acid [2,6-diamino-4-(2,3-dimethylpyrrolidino)pyridin-1-ium-1-yl] ester Formula: C11H19N4O4S+ MolecularWeight: 303.35796

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1C)C2=CC(=[N+](C(=C2)N)OS(=O)(=O)O)N

Isomeric SMILES

CC1CCN(C1C)C2=CC(=[N+](C(=C2)N)OS(=O)(=O)O)N

InChI

InChI=1S/C11H18N4O4S/c1-7-3-4-14(8(7)2)9-5-10(12)15(11(13)6-9)19-20(16,17)18/h5-8H,3-4H2,1-2H3,(H4,12,13,16,17,18)/p+1