1-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-3-phenyl-urea

Systemtic Name: 1-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-3-phenyl-urea Openeye Name: 1-[3-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-3-oxo-propyl]-3-phenyl-urea CAS Name: 1-[3-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-3-oxopropyl]-3-phenylurea IUPAC Name: 1-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxopropyl]-3-phenylurea Traditional Name: 1-[3-keto-3-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propyl]-3-phenyl-urea Formula: C25H29N4O2+ MolecularWeight: 417.52336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)CCNC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)CCNC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2/c30-24(13-14-26-25(31)27-22-10-2-1-3-11-22)29-17-15-28(16-18-29)19-21-9-6-8-20-7-4-5-12-23(20)21/h1-12H,13-19H2,(H2,26,27,31)/p+1