N-[(4-methoxyphenyl)methyl]-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-4-oxo-4-piperazin-4-ium-1-yl-butanamide CAS Name: N-[(4-methoxyphenyl)methyl]-4-oxo-4-(1-piperazin-4-iumyl)butanamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-oxo-4-piperazin-4-ium-1-ylbutanamide Traditional Name: 4-keto-N-p-anisyl-4-piperazin-4-ium-1-yl-butyramide Formula: C16H24N3O3+ MolecularWeight: 306.38006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3/c1-22-14-4-2-13(3-5-14)12-18-15(20)6-7-16(21)19-10-8-17-9-11-19/h2-5,17H,6-12H2,1H3,(H,18,20)/p+1