[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl] 4-phenoxybutanoate

Systemtic Name: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxidanylidene-ethyl] 4-phenoxybutanoate Openeye Name: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxo-ethyl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [2-[[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxoethyl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-keto-ethyl] ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)NC(=O)COC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)NC(=O)COC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O5/c24-19(23-21(26)22-14-13-17-8-3-1-4-9-17)16-28-20(25)12-7-15-27-18-10-5-2-6-11-18/h2,5-6,8,10-11H,1,3-4,7,9,12-16H2,(H2,22,23,24,26)