ethyl 4-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C16H29N4O4+ MolecularWeight: 341.42586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C16H28N4O4/c1-3-24-16(23)20-6-4-14(5-7-20)17-15(22)12-18-8-10-19(11-9-18)13(2)21/h14H,3-12H2,1-2H3,(H,17,22)/p+1