(3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxidanylidene-N-(2-pyridin-3-yloxyethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxidanylidene-N-(2-pyridin-3-yloxyethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxo-N-[2-(3-pyridyloxy)ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-[3-(4-morpholin-4-iumyl)propyl]-6-oxo-N-[2-(3-pyridinyloxy)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxo-N-(2-pyridin-3-yloxyethyl)piperidine-3-carboxamide Traditional Name: (3S)-6-keto-1-(3-morpholin-4-ium-4-ylpropyl)-N-[2-(3-pyridyloxy)ethyl]nipecotamide Formula: C20H31N4O4+ MolecularWeight: 391.48454

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCCOC2=CN=CC=C2)CCC[NH+]3CCOCC3

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NCCOC2=CN=CC=C2)CCC[NH+]3CCOCC3

InChI

InChI=1S/C20H30N4O4/c25-19-5-4-17(16-24(19)9-2-8-23-10-13-27-14-11-23)20(26)22-7-12-28-18-3-1-6-21-15-18/h1,3,6,15,17H,2,4-5,7-14,16H2,(H,22,26)/p+1/t17-/m0/s1