1-phenyl-3-[[2-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]urea

Systemtic Name: 1-phenyl-3-[[2-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]urea Openeye Name: 1-phenyl-3-[[2-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]urea CAS Name: 1-phenyl-3-[[2-[(4-phenyl-1-piperazin-1-iumyl)methyl]phenyl]methyl]urea IUPAC Name: 1-phenyl-3-[[2-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenyl]methyl]urea Traditional Name: 1-phenyl-3-[2-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzyl]urea Formula: C25H29N4O+ MolecularWeight: 401.52396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2CNC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2CNC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O/c30-25(27-23-11-3-1-4-12-23)26-19-21-9-7-8-10-22(21)20-28-15-17-29(18-16-28)24-13-5-2-6-14-24/h1-14H,15-20H2,(H2,26,27,30)/p+1