N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]but-3-enamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]but-3-enamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]but-3-enamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-3-butenamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]but-3-enamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]but-3-enamide Formula: C16H29N2O+ MolecularWeight: 265.41426

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=O)NC1CCC[NH+](C1)C2CCCCCC2

Isomeric SMILES

C=CCC(=O)N[C@H]1CCC[NH+](C1)C2CCCCCC2

InChI

InChI=1S/C16H28N2O/c1-2-8-16(19)17-14-9-7-12-18(13-14)15-10-5-3-4-6-11-15/h2,14-15H,1,3-13H2,(H,17,19)/p+1/t14-/m0/s1