(3R)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]piperidin-1-ium-3-ol

Systemtic Name: (3R)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]piperidin-1-ium-3-ol Openeye Name: (3R)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]piperidin-1-ium-3-ol CAS Name: (3R)-1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-3-piperidin-1-iumol IUPAC Name: (3R)-1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]piperidin-1-ium-3-ol Traditional Name: (3R)-1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]piperidin-1-ium-3-ol Formula: C11H19N4O3+ MolecularWeight: 255.29356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C[NH+]2CCCC(C2)O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C[NH+]2CCC[C@H](C2)O)C)[N+](=O)[O-]

InChI

InChI=1S/C11H18N4O3/c1-8-11(15(17)18)9(2)14(12-8)7-13-5-3-4-10(16)6-13/h10,16H,3-7H2,1-2H3/p+1/t10-/m1/s1