2-(2,4-dimethoxyphenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone

Systemtic Name: 2-(2,4-dimethoxyphenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Openeye Name: 2-(2,4-dimethoxyphenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone CAS Name: 2-(2,4-dimethoxyphenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone IUPAC Name: 2-(2,4-dimethoxyphenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Traditional Name: 2-(2,4-dimethoxyphenyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Formula: C16H25N2O3+ MolecularWeight: 293.3813

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C16H24N2O3/c1-17-7-4-8-18(10-9-17)16(19)11-13-5-6-14(20-2)12-15(13)21-3/h5-6,12H,4,7-11H2,1-3H3/p+1