N-[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-5-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-5-nitro-pyridin-1-ium-2-amine Openeye Name: N-[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-5-nitro-pyridin-1-ium-2-amine CAS Name: N-[(R)-(1-methyl-2-imidazolyl)-phenylmethyl]-5-nitro-2-pyridin-1-iumamine IUPAC Name: N-[(R)-(1-methylimidazol-2-yl)-phenylmethyl]-5-nitropyridin-1-ium-2-amine Traditional Name: [(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-(5-nitropyridin-1-ium-2-yl)amine Formula: C16H16N5O2+ MolecularWeight: 310.33054

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC3=[NH+]C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1[C@@H](C2=CC=CC=C2)NC3=[NH+]C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O2/c1-20-10-9-17-16(20)15(12-5-3-2-4-6-12)19-14-8-7-13(11-18-14)21(22)23/h2-11,15H,1H3,(H,18,19)/p+1/t15-/m1/s1