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

Systemtic Name: 1-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]urea Openeye Name: [3-[4-(1-naphthylmethyl)piperazin-4-ium-1-carbonyl]phenyl]urea CAS Name: [3-[[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]urea IUPAC Name: [3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-carbonyl]phenyl]urea Traditional Name: [3-[4-(1-naphthylmethyl)piperazin-4-ium-1-carbonyl]phenyl]urea Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)C4=CC(=CC=C4)NC(=O)N

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)C4=CC(=CC=C4)NC(=O)N

InChI

InChI=1S/C23H24N4O2/c24-23(29)25-20-9-4-7-18(15-20)22(28)27-13-11-26(12-14-27)16-19-8-3-6-17-5-1-2-10-21(17)19/h1-10,15H,11-14,16H2,(H3,24,25,29)/p+1