(3,4-diethoxyphenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3,4-diethoxyphenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(3,4-diethoxyphenyl)methanone CAS Name: (3,4-diethoxyphenyl)-(4-prop-2-enyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3,4-diethoxyphenyl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(3,4-diethoxyphenyl)methanone Formula: C18H27N2O3+ MolecularWeight: 319.41858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC=C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC=C)OCC

InChI

InChI=1S/C18H26N2O3/c1-4-9-19-10-12-20(13-11-19)18(21)15-7-8-16(22-5-2)17(14-15)23-6-3/h4,7-8,14H,1,5-6,9-13H2,2-3H3/p+1