1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-ethyl-1,4-diazepan-1-ium-5-one

Systemtic Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-ethyl-1,4-diazepan-1-ium-5-one Openeye Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-ethyl-1,4-diazepan-1-ium-5-one CAS Name: 1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-ethyl-1,4-diazepan-1-ium-5-one IUPAC Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-ethyl-1,4-diazepan-1-ium-5-one Traditional Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-ethyl-1,4-diazepan-1-ium-5-one Formula: C14H25N2O+ MolecularWeight: 237.3611

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CCC1=O)CC2CCC=CC2

Isomeric SMILES

CCN1CC[NH+](CCC1=O)C[C@H]2CCC=CC2

InChI

InChI=1S/C14H24N2O/c1-2-16-11-10-15(9-8-14(16)17)12-13-6-4-3-5-7-13/h3-4,13H,2,5-12H2,1H3/p+1/t13-/m1/s1