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

Systemtic Name: 1-phenyl-3-[2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethyl]urea Openeye Name: 1-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-3-phenyl-urea CAS Name: 1-phenyl-3-[2-[4-(phenylmethyl)-1-piperazin-1-iumyl]ethyl]urea IUPAC Name: 1-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-3-phenylurea Traditional Name: 1-[2-(4-benzylpiperazin-1-ium-1-yl)ethyl]-3-phenyl-urea Formula: C20H27N4O+ MolecularWeight: 339.45458

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)NC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)NC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N4O/c25-20(22-19-9-5-2-6-10-19)21-11-12-23-13-15-24(16-14-23)17-18-7-3-1-4-8-18/h1-10H,11-17H2,(H2,21,22,25)/p+1