N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-4-(2-oxidanylidenepiperidin-1-yl)butanamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-4-(2-oxidanylidenepiperidin-1-yl)butanamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-4-(2-oxo-1-piperidyl)butanamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-4-(2-oxo-1-piperidinyl)butanamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-4-(2-oxopiperidin-1-yl)butanamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-4-(2-ketopiperidino)butyramide Formula: C21H38N3O2+ MolecularWeight: 364.54532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CCCC(C2)NC(=O)CCCN3CCCCC3=O

Isomeric SMILES

C1CCCC(CC1)[NH+]2CCC[C@@H](C2)NC(=O)CCCN3CCCCC3=O

InChI

InChI=1S/C21H37N3O2/c25-20(12-8-15-23-14-6-5-13-21(23)26)22-18-9-7-16-24(17-18)19-10-3-1-2-4-11-19/h18-19H,1-17H2,(H,22,25)/p+1/t18-/m0/s1