1-ethyl-3-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]urea

Systemtic Name: 1-ethyl-3-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]urea Openeye Name: 1-ethyl-3-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]urea CAS Name: 1-ethyl-3-[[2-[4-(2-methoxyphenyl)-1-piperazinyl]-3-pyridin-1-iumyl]methyl]urea IUPAC Name: 1-ethyl-3-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-yl]methyl]urea Traditional Name: 1-ethyl-3-[[2-[4-(2-methoxyphenyl)piperazino]pyridin-1-ium-3-yl]methyl]urea Formula: C20H28N5O2+ MolecularWeight: 370.46862

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NCC1=C([NH+]=CC=C1)N2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CCNC(=O)NCC1=C([NH+]=CC=C1)N2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C20H27N5O2/c1-3-21-20(26)23-15-16-7-6-10-22-19(16)25-13-11-24(12-14-25)17-8-4-5-9-18(17)27-2/h4-10H,3,11-15H2,1-2H3,(H2,21,23,26)/p+1