1-[2-[4-(4-chloranyl-3-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-3-phenyl-urea

Systemtic Name: 1-[2-[4-(4-chloranyl-3-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-3-phenyl-urea Openeye Name: 1-[2-[4-(4-chloro-3-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-3-phenyl-urea CAS Name: 1-[2-[4-(4-chloro-3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-3-phenylurea IUPAC Name: 1-[2-[4-(4-chloro-3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-3-phenylurea Traditional Name: 1-[2-[4-(4-chloro-3-methyl-phenyl)piperazin-1-ium-1-yl]ethyl]-3-phenyl-urea Formula: C20H26ClN4O+ MolecularWeight: 373.89964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)CCNC(=O)NC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)CCNC(=O)NC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H25ClN4O/c1-16-15-18(7-8-19(16)21)25-13-11-24(12-14-25)10-9-22-20(26)23-17-5-3-2-4-6-17/h2-8,15H,9-14H2,1H3,(H2,22,23,26)/p+1