(3S)-3-methyl-1-(5-nitropyridin-2-yl)piperazin-4-ium

Systemtic Name: (3S)-3-methyl-1-(5-nitropyridin-2-yl)piperazin-4-ium Openeye Name: (3S)-3-methyl-1-(5-nitro-2-pyridyl)piperazin-4-ium CAS Name: (3S)-3-methyl-1-(5-nitro-2-pyridinyl)piperazin-4-ium IUPAC Name: (3S)-3-methyl-1-(5-nitropyridin-2-yl)piperazin-4-ium Traditional Name: (3S)-3-methyl-1-(5-nitro-2-pyridyl)piperazin-4-ium Formula: C10H15N4O2+ MolecularWeight: 223.2517

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH2+]1)C2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CN(CC[NH2+]1)C2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H14N4O2/c1-8-7-13(5-4-11-8)10-3-2-9(6-12-10)14(15)16/h2-3,6,8,11H,4-5,7H2,1H3/p+1/t8-/m0/s1