(3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxidanylidene-N-(3-pyrazol-1-ylpropyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxidanylidene-N-(3-pyrazol-1-ylpropyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxo-N-(3-pyrazol-1-ylpropyl)piperidine-3-carboxamide CAS Name: (3S)-1-[3-(4-morpholin-4-iumyl)propyl]-6-oxo-N-[3-(1-pyrazolyl)propyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxo-N-(3-pyrazol-1-ylpropyl)piperidine-3-carboxamide Traditional Name: (3S)-6-keto-1-(3-morpholin-4-ium-4-ylpropyl)-N-(3-pyrazol-1-ylpropyl)nipecotamide Formula: C19H32N5O3+ MolecularWeight: 378.48908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)NCCCN2C=CC=N2)CCC[NH+]3CCOCC3

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)NCCCN2C=CC=N2)CCC[NH+]3CCOCC3

InChI

InChI=1S/C19H31N5O3/c25-18-5-4-17(19(26)20-6-1-10-24-11-2-7-21-24)16-23(18)9-3-8-22-12-14-27-15-13-22/h2,7,11,17H,1,3-6,8-10,12-16H2,(H,20,26)/p+1/t17-/m0/s1