1-[3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-urea

Systemtic Name: 1-[3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-urea Openeye Name: 1-[3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-urea CAS Name: 1-[3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]propyl]-3-phenylurea IUPAC Name: 1-[3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenylurea Traditional Name: 1-[3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-urea Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CCCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CCCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O2/c1-27-20-11-6-5-10-19(20)25-16-14-24(15-17-25)13-7-12-22-21(26)23-18-8-3-2-4-9-18/h2-6,8-11H,7,12-17H2,1H3,(H2,22,23,26)/p+1