(6-chloranylpyridin-3-yl)methyl 2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 2-cyclohexyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 2-cyclohexyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-cyclohexyl-1,3-dioxo-5-isoindolecarboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 2-cyclohexyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-cyclohexyl-1,3-diketo-isoindoline-5-carboxylic acid (6-chloro-3-pyridyl)methyl ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CN=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CN=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN2O4/c22-18-9-6-13(11-23-18)12-28-21(27)14-7-8-16-17(10-14)20(26)24(19(16)25)15-4-2-1-3-5-15/h6-11,15H,1-5,12H2