ethyl 4-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxo-ethyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[2-[[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]amino]-2-oxoethyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxoethyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-keto-ethyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C18H31N4O4+ MolecularWeight: 367.46314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CC(=O)NC(=O)NCCC2=CCCCC2

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)CC(=O)NC(=O)NCCC2=CCCCC2

InChI

InChI=1S/C18H30N4O4/c1-2-26-18(25)22-12-10-21(11-13-22)14-16(23)20-17(24)19-9-8-15-6-4-3-5-7-15/h6H,2-5,7-14H2,1H3,(H2,19,20,23,24)/p+1