2,3-dihydro-1,4-dioxin-5-yl-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-dioxin-5-yl-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-dioxin-5-yl-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: 2,3-dihydro-1,4-dioxin-5-yl-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: 2,3-dihydro-1,4-dioxin-5-yl-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: 2,3-dihydro-p-dioxin-5-yl-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazin-4-ium-1-yl]methanone Formula: C19H27N2O5+ MolecularWeight: 363.42808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+]2CCN(CC2)C(=O)C3=COCCO3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+]2CCN(CC2)C(=O)C3=COCCO3)OC)OC

InChI

InChI=1S/C19H26N2O5/c1-14-10-16(23-2)17(24-3)11-15(14)12-20-4-6-21(7-5-20)19(22)18-13-25-8-9-26-18/h10-11,13H,4-9,12H2,1-3H3/p+1