(3S)-N-cyclohexyl-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxidanylidene-N-prop-2-ynyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-cyclohexyl-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxidanylidene-N-prop-2-ynyl-piperidine-3-carboxamide Openeye Name: (3S)-N-cyclohexyl-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxo-N-prop-2-ynyl-piperidine-3-carboxamide CAS Name: (3S)-N-cyclohexyl-1-[3-(4-morpholin-4-iumyl)propyl]-6-oxo-N-prop-2-ynyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-cyclohexyl-1-(3-morpholin-4-ium-4-ylpropyl)-6-oxo-N-prop-2-ynylpiperidine-3-carboxamide Traditional Name: (3S)-N-cyclohexyl-6-keto-1-(3-morpholin-4-ium-4-ylpropyl)-N-propargyl-nipecotamide Formula: C22H36N3O3+ MolecularWeight: 390.53954

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1CCCCC1)C(=O)C2CCC(=O)N(C2)CCC[NH+]3CCOCC3

Isomeric SMILES

C#CCN(C1CCCCC1)C(=O)[C@H]2CCC(=O)N(C2)CCC[NH+]3CCOCC3

InChI

InChI=1S/C22H35N3O3/c1-2-11-25(20-7-4-3-5-8-20)22(27)19-9-10-21(26)24(18-19)13-6-12-23-14-16-28-17-15-23/h1,19-20H,3-18H2/p+1/t19-/m0/s1