1-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-[[(1S)-1-cyclohex-3-enyl]methyl]-1-piperazin-4-iumyl]-2-phenylethanone IUPAC Name: 1-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-2-phenylethanone Traditional Name: 1-[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-2-phenyl-ethanone Formula: C19H27N2O+ MolecularWeight: 299.43048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O/c22-19(15-17-7-3-1-4-8-17)21-13-11-20(12-14-21)16-18-9-5-2-6-10-18/h1-5,7-8,18H,6,9-16H2/p+1/t18-/m1/s1