1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-ethyl-piperazine-1,4-diium

Systemtic Name: 1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-ethyl-piperazine-1,4-diium Openeye Name: 1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-ethyl-piperazine-1,4-diium CAS Name: 1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-ethylpiperazine-1,4-diium IUPAC Name: 1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-ethylpiperazine-1,4-diium Traditional Name: 1-(3-ethoxy-4-methoxy-benzyl)-4-ethyl-piperazine-1,4-diium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=CC(=C(C=C2)OC)OCC

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=CC(=C(C=C2)OC)OCC

InChI

InChI=1S/C16H26N2O2/c1-4-17-8-10-18(11-9-17)13-14-6-7-15(19-3)16(12-14)20-5-2/h6-7,12H,4-5,8-11,13H2,1-3H3/p+2