[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate CAS Name: 2-[2-(1-cyclohexenyl)ethylamino]benzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-[2-(cyclohexen-1-yl)ethylamino]benzoate Traditional Name: 2-[2-(cyclohexen-1-yl)ethylamino]benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O4/c1-15(2)23-21(27)24-19(25)14-28-20(26)17-10-6-7-11-18(17)22-13-12-16-8-4-3-5-9-16/h6-8,10-11,15,22H,3-5,9,12-14H2,1-2H3,(H2,23,24,25,27)