N-(2-ethoxyphenyl)-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide

Systemtic Name: N-(2-ethoxyphenyl)-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide Openeye Name: N-(2-ethoxyphenyl)-4-oxo-4-piperazin-4-ium-1-yl-butanamide CAS Name: N-(2-ethoxyphenyl)-4-oxo-4-(1-piperazin-4-iumyl)butanamide IUPAC Name: N-(2-ethoxyphenyl)-4-oxo-4-piperazin-4-ium-1-ylbutanamide Traditional Name: 4-keto-N-o-phenetyl-4-piperazin-4-ium-1-yl-butyramide Formula: C16H24N3O3+ MolecularWeight: 306.38006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CCC(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CCC(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C16H23N3O3/c1-2-22-14-6-4-3-5-13(14)18-15(20)7-8-16(21)19-11-9-17-10-12-19/h3-6,17H,2,7-12H2,1H3,(H,18,20)/p+1