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

Systemtic Name: (3S)-N-(2-dimethylaminoethyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-dimethylaminoethyl)-1-(5-nitro-2-pyridyl)piperidine-3-carboxamide CAS Name: (3S)-N-(2-dimethylaminoethyl)-1-(5-nitro-2-pyridinyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-dimethylaminoethyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide Traditional Name: (3S)-N-(2-dimethylaminoethyl)-1-(5-nitro-2-pyridyl)nipecotamide Formula: C15H23N5O3 MolecularWeight: 321.37482

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1CCCN(C1)C2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNC(=O)[C@H]1CCCN(C1)C2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H23N5O3/c1-18(2)9-7-16-15(21)12-4-3-8-19(11-12)14-6-5-13(10-17-14)20(22)23/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H,16,21)/t12-/m0/s1