(3S)-N-(3-morpholin-4-ylpropyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(3-morpholin-4-ylpropyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide Openeye Name: (3S)-N-(3-morpholinopropyl)-1-(5-nitro-2-pyridyl)piperidine-3-carboxamide CAS Name: (3S)-N-[3-(4-morpholinyl)propyl]-1-(5-nitro-2-pyridinyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(3-morpholin-4-ylpropyl)-1-(5-nitropyridin-2-yl)piperidine-3-carboxamide Traditional Name: (3S)-N-(3-morpholinopropyl)-1-(5-nitro-2-pyridyl)nipecotamide Formula: C18H27N5O4 MolecularWeight: 377.43808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3CCOCC3

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3CCOCC3

InChI

InChI=1S/C18H27N5O4/c24-18(19-6-2-7-21-9-11-27-12-10-21)15-3-1-8-22(14-15)17-5-4-16(13-20-17)23(25)26/h4-5,13,15H,1-3,6-12,14H2,(H,19,24)/t15-/m0/s1