[4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(2,3-dimethoxyphenyl)methanone

Systemtic Name: [4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(2,3-dimethoxyphenyl)methanone Openeye Name: [4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(2,3-dimethoxyphenyl)methanone CAS Name: [4-[[(1S)-1-cyclohex-3-enyl]methyl]-1-piperazin-4-iumyl]-(2,3-dimethoxyphenyl)methanone IUPAC Name: [4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(2,3-dimethoxyphenyl)methanone Traditional Name: [4-[[(1S)-cyclohex-3-en-1-yl]methyl]piperazin-4-ium-1-yl]-(2,3-dimethoxyphenyl)methanone Formula: C20H29N2O3+ MolecularWeight: 345.45586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)N2CC[NH+](CC2)CC3CCC=CC3

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)N2CC[NH+](CC2)C[C@H]3CCC=CC3

InChI

InChI=1S/C20H28N2O3/c1-24-18-10-6-9-17(19(18)25-2)20(23)22-13-11-21(12-14-22)15-16-7-4-3-5-8-16/h3-4,6,9-10,16H,5,7-8,11-15H2,1-2H3/p+1/t16-/m1/s1