[4-[[(1R)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(3,5-dimethoxyphenyl)methanone

Systemtic Name: [4-[[(1R)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(3,5-dimethoxyphenyl)methanone Openeye Name: [4-[[(1R)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(3,5-dimethoxyphenyl)methanone CAS Name: [4-[[(1R)-1-cyclohex-3-enyl]methyl]-1-piperazin-4-iumyl]-(3,5-dimethoxyphenyl)methanone IUPAC Name: [4-[[(1R)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(3,5-dimethoxyphenyl)methanone Traditional Name: [4-[[(1R)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(3,5-dimethoxyphenyl)methanone Formula: C20H29N2O3+ MolecularWeight: 345.45586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CC[NH+](CC2)CC3CCC=CC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CC[NH+](CC2)C[C@@H]3CCC=CC3)OC

InChI

InChI=1S/C20H28N2O3/c1-24-18-12-17(13-19(14-18)25-2)20(23)22-10-8-21(9-11-22)15-16-6-4-3-5-7-16/h3-4,12-14,16H,5-11,15H2,1-2H3/p+1/t16-/m0/s1