[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-cyclohexyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-cyclohexyl-1,3-dioxo-5-isoindolecarboxylic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-cyclohexyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-cyclohexyl-1,3-diketo-isoindoline-5-carboxylic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3CCCCC3

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3CCCCC3

InChI

InChI=1S/C21H25N3O6/c1-12(2)22-21(29)23-17(25)11-30-20(28)13-8-9-15-16(10-13)19(27)24(18(15)26)14-6-4-3-5-7-14/h8-10,12,14H,3-7,11H2,1-2H3,(H2,22,23,25,29)