4-methoxy-N-(4-oxidanylidene-4-piperazin-4-ium-1-yl-butyl)benzamide

Systemtic Name: 4-methoxy-N-(4-oxidanylidene-4-piperazin-4-ium-1-yl-butyl)benzamide Openeye Name: 4-methoxy-N-(4-oxo-4-piperazin-4-ium-1-yl-butyl)benzamide CAS Name: 4-methoxy-N-[4-oxo-4-(1-piperazin-4-iumyl)butyl]benzamide IUPAC Name: 4-methoxy-N-(4-oxo-4-piperazin-4-ium-1-ylbutyl)benzamide Traditional Name: N-(4-keto-4-piperazin-4-ium-1-yl-butyl)-4-methoxy-benzamide Formula: C16H24N3O3+ MolecularWeight: 306.38006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCCCC(=O)N2CC[NH2+]CC2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCCCC(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C16H23N3O3/c1-22-14-6-4-13(5-7-14)16(21)18-8-2-3-15(20)19-11-9-17-10-12-19/h4-7,17H,2-3,8-12H2,1H3,(H,18,21)/p+1