1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Openeye Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]propan-1-one CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-3-[4-(2-pyridinylmethyl)-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]propan-1-one Traditional Name: 1-[4-(4-methoxyphenyl)piperazino]-3-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]propan-1-one Formula: C24H34N5O2+ MolecularWeight: 424.55906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCN3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCN3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C24H33N5O2/c1-31-23-7-5-22(6-8-23)28-16-18-29(19-17-28)24(30)9-11-26-12-14-27(15-13-26)20-21-4-2-3-10-25-21/h2-8,10H,9,11-20H2,1H3/p+1