[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate CAS Name: 2-[2-(1-cyclohexenyl)ethylamino]benzoic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate Traditional Name: 2-[2-(cyclohexen-1-yl)ethylamino]benzoic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)COC(=O)C1=CC=CC=C1NCCC2=CCCCC2

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)COC(=O)C1=CC=CC=C1NCCC2=CCCCC2

InChI

InChI=1S/C22H31N3O4/c1-22(2,3)25-21(28)24-19(26)15-29-20(27)17-11-7-8-12-18(17)23-14-13-16-9-5-4-6-10-16/h7-9,11-12,23H,4-6,10,13-15H2,1-3H3,(H2,24,25,26,28)