N'-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-N-(pyridin-2-ylmethyl)butanediamide

Systemtic Name: N'-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-N-(pyridin-2-ylmethyl)butanediamide Openeye Name: N'-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-N-(2-pyridylmethyl)butanediamide CAS Name: N'-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-N-(2-pyridinylmethyl)butanediamide IUPAC Name: N'-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-N-(pyridin-2-ylmethyl)butanediamide Traditional Name: N'-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-N-(2-pyridylmethyl)succinamide Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)CCC(=O)NCC2=CC=CC=N2

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC(=O)CCC(=O)NCC2=CC=CC=N2

InChI

InChI=1S/C18H27N3O2/c1-13-6-5-8-16(14(13)2)21-18(23)10-9-17(22)20-12-15-7-3-4-11-19-15/h3-4,7,11,13-14,16H,5-6,8-10,12H2,1-2H3,(H,20,22)(H,21,23)/t13-,14+,16-/m0/s1