2,6-bis(azanyl)-4-piperidin-1-yl-pyrimidin-1-ium-1-sulfonic acid

Systemtic Name: 2,6-bis(azanyl)-4-piperidin-1-yl-pyrimidin-1-ium-1-sulfonic acid Openeye Name: 2,6-diamino-4-(1-piperidyl)pyrimidin-1-ium-1-sulfonic acid CAS Name: 2,6-diamino-4-(1-piperidinyl)-1-pyrimidin-1-iumsulfonic acid IUPAC Name: 2,6-diamino-4-piperidin-1-ylpyrimidin-1-ium-1-sulfonic acid Traditional Name: 2,6-diamino-4-piperidino-pyrimidin-1-ium-1-sulfonic acid Formula: C9H16N5O3S+ MolecularWeight: 274.32004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=[N+](C(=N2)N)S(=O)(=O)O)N

Isomeric SMILES

C1CCN(CC1)C2=CC(=[N+](C(=N2)N)S(=O)(=O)O)N

InChI

InChI=1S/C9H15N5O3S/c10-7-6-8(13-4-2-1-3-5-13)12-9(11)14(7)18(15,16)17/h6H,1-5H2,(H4,10,11,12,15,16,17)/p+1