5-nitro-N-[1-(phenylmethyl)piperidin-3-yl]pyridin-2-amine

Systemtic Name: 5-nitro-N-[1-(phenylmethyl)piperidin-3-yl]pyridin-2-amine Openeye Name: N-(1-benzyl-3-piperidyl)-5-nitro-pyridin-2-amine CAS Name: 5-nitro-N-[1-(phenylmethyl)-3-piperidinyl]-2-pyridinamine IUPAC Name: N-(1-benzylpiperidin-3-yl)-5-nitropyridin-2-amine Traditional Name: (1-benzyl-3-piperidyl)-(5-nitro-2-pyridyl)amine Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2)NC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC=C2)NC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O2/c22-21(23)16-8-9-17(18-11-16)19-15-7-4-10-20(13-15)12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,15H,4,7,10,12-13H2,(H,18,19)