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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[NH+]2CCCC(C2)NC(=O)CCCN3CCCCC3=O

Isomeric SMILES

C1CCC(CC1)C[NH+]2CCC[C@@H](C2)NC(=O)CCCN3CCCCC3=O

InChI

InChI=1S/C21H37N3O2/c25-20(11-7-15-24-14-5-4-12-21(24)26)22-19-10-6-13-23(17-19)16-18-8-2-1-3-9-18/h18-19H,1-17H2,(H,22,25)/p+1/t19-/m0/s1