1-(2,5-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-ethanone

Systemtic Name: 1-(2,5-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-ethanone Openeye Name: 1-(2,5-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-ethanone CAS Name: 1-(2,5-dimethoxyphenyl)-2-(1-piperazin-4-iumyl)ethanone IUPAC Name: 1-(2,5-dimethoxyphenyl)-2-piperazin-4-ium-1-ylethanone Traditional Name: 1-(2,5-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-ethanone Formula: C14H21N2O3+ MolecularWeight: 265.32814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)CN2CC[NH2+]CC2

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)CN2CC[NH2+]CC2

InChI

InChI=1S/C14H20N2O3/c1-18-11-3-4-14(19-2)12(9-11)13(17)10-16-7-5-15-6-8-16/h3-4,9,15H,5-8,10H2,1-2H3/p+1