2-[4-(2-methoxyphenyl)piperidin-1-yl]-3-nitro-pyridin-1-ium

Systemtic Name: 2-[4-(2-methoxyphenyl)piperidin-1-yl]-3-nitro-pyridin-1-ium Openeye Name: 2-[4-(2-methoxyphenyl)-1-piperidyl]-3-nitro-pyridin-1-ium CAS Name: 2-[4-(2-methoxyphenyl)-1-piperidinyl]-3-nitropyridin-1-ium IUPAC Name: 2-[4-(2-methoxyphenyl)piperidin-1-yl]-3-nitropyridin-1-ium Traditional Name: 2-[4-(2-methoxyphenyl)piperidino]-3-nitro-pyridin-1-ium Formula: C17H20N3O3+ MolecularWeight: 314.359

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CCN(CC2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C2CCN(CC2)C3=C(C=CC=[NH+]3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3/c1-23-16-7-3-2-5-14(16)13-8-11-19(12-9-13)17-15(20(21)22)6-4-10-18-17/h2-7,10,13H,8-9,11-12H2,1H3/p+1