1-[3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]urea

Systemtic Name: 1-[3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]urea Openeye Name: [3-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]urea CAS Name: [3-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]urea IUPAC Name: [3-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]urea Traditional Name: [3-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]urea Formula: C25H27N4O2+ MolecularWeight: 415.50748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)NC(=O)N

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)NC(=O)N

InChI

InChI=1S/C25H26N4O2/c26-25(31)27-22-13-7-12-21(18-22)24(30)29-16-14-28(15-17-29)23(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-13,18,23H,14-17H2,(H3,26,27,31)/p+1