2,2-dimethyl-1-piperazin-4-ium-1-yl-3-(2-prop-2-enylphenoxy)propan-1-one

Systemtic Name: 2,2-dimethyl-1-piperazin-4-ium-1-yl-3-(2-prop-2-enylphenoxy)propan-1-one Openeye Name: 3-(2-allylphenoxy)-2,2-dimethyl-1-piperazin-4-ium-1-yl-propan-1-one CAS Name: 2,2-dimethyl-1-(1-piperazin-4-iumyl)-3-(2-prop-2-enylphenoxy)-1-propanone IUPAC Name: 2,2-dimethyl-1-piperazin-4-ium-1-yl-3-(2-prop-2-enylphenoxy)propan-1-one Traditional Name: 3-(2-allylphenoxy)-2,2-dimethyl-1-piperazin-4-ium-1-yl-propan-1-one Formula: C18H27N2O2+ MolecularWeight: 303.41918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC=CC=C1CC=C)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)(COC1=CC=CC=C1CC=C)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C18H26N2O2/c1-4-7-15-8-5-6-9-16(15)22-14-18(2,3)17(21)20-12-10-19-11-13-20/h4-6,8-9,19H,1,7,10-14H2,2-3H3/p+1