1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-(pyridin-4-ylmethyl)piperazin-1-ium

Systemtic Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-(pyridin-4-ylmethyl)piperazin-1-ium Openeye Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-(4-pyridylmethyl)piperazin-1-ium CAS Name: 1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-(pyridin-4-ylmethyl)piperazin-1-ium IUPAC Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-(pyridin-4-ylmethyl)piperazin-1-ium Traditional Name: 1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-(4-pyridylmethyl)piperazin-1-ium Formula: C17H26N3+ MolecularWeight: 272.40844

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C[NH+]2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH+]2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C17H25N3/c1-2-4-16(5-3-1)14-19-10-12-20(13-11-19)15-17-6-8-18-9-7-17/h1-2,6-9,16H,3-5,10-15H2/p+1/t16-/m1/s1