3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-piperidin-1-iumyl]-1-(4-ethyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-1-(4-ethylpiperazino)propan-1-one Formula: C21H38N3O+ MolecularWeight: 348.54592

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CCC2CC[NH+](CC2)CC3CCC=CC3

Isomeric SMILES

CCN1CCN(CC1)C(=O)CCC2CC[NH+](CC2)C[C@H]3CCC=CC3

InChI

InChI=1S/C21H37N3O/c1-2-22-14-16-24(17-15-22)21(25)9-8-19-10-12-23(13-11-19)18-20-6-4-3-5-7-20/h3-4,19-20H,2,5-18H2,1H3/p+1/t20-/m1/s1