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

Systemtic Name: 1-[3-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]urea Openeye Name: [3-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]urea CAS Name: [3-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]phenyl]urea IUPAC Name: [3-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]urea Traditional Name: [3-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]urea Formula: C19H23N4O2+ MolecularWeight: 339.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)NC(=O)N

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)NC(=O)N

InChI

InChI=1S/C19H22N4O2/c20-19(25)21-17-8-4-7-16(13-17)18(24)23-11-9-22(10-12-23)14-15-5-2-1-3-6-15/h1-8,13H,9-12,14H2,(H3,20,21,25)/p+1