2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanamide

Systemtic Name: 2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-acetamide CAS Name: 2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoacetamide Traditional Name: 2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-acetamide Formula: C13H18N3O2+ MolecularWeight: 248.30092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O2/c14-12(17)13(18)16-8-6-15(7-9-16)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,14,17)/p+1