[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]butyl]azanium

Systemtic Name: [4-oxidanylidene-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]butyl]azanium Openeye Name: [4-(4-benzylpiperazin-4-ium-1-yl)-4-oxo-butyl]ammonium CAS Name: [4-oxo-4-[4-(phenylmethyl)-1-piperazin-4-iumyl]butyl]ammonium IUPAC Name: [4-(4-benzylpiperazin-4-ium-1-yl)-4-oxobutyl]azanium Traditional Name: [4-(4-benzylpiperazin-4-ium-1-yl)-4-keto-butyl]ammonium Formula: C15H25N3O+2 MolecularWeight: 263.3785

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CCC[NH3+]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CCC[NH3+]

InChI

InChI=1S/C15H23N3O/c16-8-4-7-15(19)18-11-9-17(10-12-18)13-14-5-2-1-3-6-14/h1-3,5-6H,4,7-13,16H2/p+2