1-(2-methoxyphenyl)-4-(3-nitropyridin-1-ium-2-yl)piperazine

Systemtic Name: 1-(2-methoxyphenyl)-4-(3-nitropyridin-1-ium-2-yl)piperazine Openeye Name: 1-(2-methoxyphenyl)-4-(3-nitropyridin-1-ium-2-yl)piperazine CAS Name: 1-(2-methoxyphenyl)-4-(3-nitro-2-pyridin-1-iumyl)piperazine IUPAC Name: 1-(2-methoxyphenyl)-4-(3-nitropyridin-1-ium-2-yl)piperazine Traditional Name: 1-(2-methoxyphenyl)-4-(3-nitropyridin-1-ium-2-yl)piperazine Formula: C16H19N4O3+ MolecularWeight: 315.34706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O3/c1-23-15-7-3-2-5-13(15)18-9-11-19(12-10-18)16-14(20(21)22)6-4-8-17-16/h2-8H,9-12H2,1H3/p+1