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

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 2-cyclohexyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-cyclohexyl-1,3-dioxo-5-isoindolecarboxylic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 2-cyclohexyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-cyclohexyl-1,3-diketo-isoindoline-5-carboxylic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3CCCCC3

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3CCCCC3

InChI

InChI=1S/C21H26N2O5/c1-3-11-22-18(24)13(2)28-21(27)14-9-10-16-17(12-14)20(26)23(19(16)25)15-7-5-4-6-8-15/h9-10,12-13,15H,3-8,11H2,1-2H3,(H,22,24)