N-(3-cyanophenyl)-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide

Systemtic Name: N-(3-cyanophenyl)-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide Openeye Name: N-(3-cyanophenyl)-4-oxo-4-piperazin-4-ium-1-yl-butanamide CAS Name: N-(3-cyanophenyl)-4-oxo-4-(1-piperazin-4-iumyl)butanamide IUPAC Name: N-(3-cyanophenyl)-4-oxo-4-piperazin-4-ium-1-ylbutanamide Traditional Name: N-(3-cyanophenyl)-4-keto-4-piperazin-4-ium-1-yl-butyramide Formula: C15H19N4O2+ MolecularWeight: 287.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)CCC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)CCC(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H18N4O2/c16-11-12-2-1-3-13(10-12)18-14(20)4-5-15(21)19-8-6-17-7-9-19/h1-3,10,17H,4-9H2,(H,18,20)/p+1