(3S)-6-oxidanylidene-N-(2-oxidanyl-2-prop-2-enyl-pent-4-enyl)-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-6-oxidanylidene-N-(2-oxidanyl-2-prop-2-enyl-pent-4-enyl)-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-(2-allyl-2-hydroxy-pent-4-enyl)-6-oxo-1-[2-(2-pyridyl)ethyl]piperidine-3-carboxamide CAS Name: (3S)-N-(2-hydroxy-2-prop-2-enylpent-4-enyl)-6-oxo-1-[2-(2-pyridinyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-hydroxy-2-prop-2-enylpent-4-enyl)-6-oxo-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Traditional Name: (3S)-N-(2-allyl-2-hydroxy-pent-4-enyl)-6-keto-1-[2-(2-pyridyl)ethyl]nipecotamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)(CNC(=O)C1CCC(=O)N(C1)CCC2=CC=CC=N2)O

Isomeric SMILES

C=CCC(CC=C)(CNC(=O)[C@H]1CCC(=O)N(C1)CCC2=CC=CC=N2)O

InChI

InChI=1S/C21H29N3O3/c1-3-11-21(27,12-4-2)16-23-20(26)17-8-9-19(25)24(15-17)14-10-18-7-5-6-13-22-18/h3-7,13,17,27H,1-2,8-12,14-16H2,(H,23,26)/t17-/m0/s1