(3S)-N-(furan-2-ylmethyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(furan-2-ylmethyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-furylmethyl)-1-(5-nitro-2-pyridyl)piperidine-3-carboxamide CAS Name: (3S)-N-(2-furanylmethyl)-1-(5-nitro-2-pyridinyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(furan-2-ylmethyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide Traditional Name: (3S)-N-(2-furfuryl)-1-(5-nitro-2-pyridyl)nipecotamide Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=CO3

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=CO3

InChI

InChI=1S/C16H18N4O4/c21-16(18-10-14-4-2-8-24-14)12-3-1-7-19(11-12)15-6-5-13(9-17-15)20(22)23/h2,4-6,8-9,12H,1,3,7,10-11H2,(H,18,21)/t12-/m0/s1