1-(2-methoxyphenyl)-3-[4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butyl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butyl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[4-[4-(m-tolyl)piperazin-1-ium-1-yl]butyl]urea CAS Name: 1-(2-methoxyphenyl)-3-[4-[4-(3-methylphenyl)-1-piperazin-1-iumyl]butyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butyl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[4-[4-(m-tolyl)piperazin-1-ium-1-yl]butyl]urea Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCCCNC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCCCNC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C23H32N4O2/c1-19-8-7-9-20(18-19)27-16-14-26(15-17-27)13-6-5-12-24-23(28)25-21-10-3-4-11-22(21)29-2/h3-4,7-11,18H,5-6,12-17H2,1-2H3,(H2,24,25,28)/p+1