ethanedioic acid; 3-nitro-N-(5-piperidin-1-ylpentyl)pyridin-2-amine

Systemtic Name: ethanedioic acid; 3-nitro-N-(5-piperidin-1-ylpentyl)pyridin-2-amine Openeye Name: 3-nitro-N-[5-(1-piperidyl)pentyl]pyridin-2-amine; oxalic acid CAS Name: 3-nitro-N-[5-(1-piperidinyl)pentyl]-2-pyridinamine; oxalic acid IUPAC Name: 3-nitro-N-(5-piperidin-1-ylpentyl)pyridin-2-amine; oxalic acid Traditional Name: (3-nitro-2-pyridyl)-(5-piperidinopentyl)amine; oxalic acid Formula: C17H26N4O6 MolecularWeight: 382.41154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCNC2=C(C=CC=N2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCCCCNC2=C(C=CC=N2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C15H24N4O2.C2H2O4/c20-19(21)14-8-7-10-17-15(14)16-9-3-1-4-11-18-12-5-2-6-13-18;3-1(4)2(5)6/h7-8,10H,1-6,9,11-13H2,(H,16,17);(H,3,4)(H,5,6)