1-[(2-ethoxypyridin-3-yl)methyl]-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]piperidine-3-carboxamide

Systemtic Name: 1-[(2-ethoxypyridin-3-yl)methyl]-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]piperidine-3-carboxamide Openeye Name: 1-[(2-ethoxy-3-pyridyl)methyl]-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]piperidine-3-carboxamide CAS Name: 1-[(2-ethoxy-3-pyridinyl)methyl]-N-[2-[(5-nitro-2-pyridinyl)amino]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2-ethoxypyridin-3-yl)methyl]-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]piperidine-3-carboxamide Traditional Name: 1-[(2-ethoxy-3-pyridyl)methyl]-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]nipecotamide Formula: C21H28N6O4 MolecularWeight: 428.48482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)CN2CCCC(C2)C(=O)NCCNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC=N1)CN2CCCC(C2)C(=O)NCCNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H28N6O4/c1-2-31-21-17(5-3-9-24-21)15-26-12-4-6-16(14-26)20(28)23-11-10-22-19-8-7-18(13-25-19)27(29)30/h3,5,7-9,13,16H,2,4,6,10-12,14-15H2,1H3,(H,22,25)(H,23,28)