(6-chloranylpyridin-3-yl)methyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 2-(4-ethoxyphenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-ethoxyphenyl)-1,3-dioxo-5-isoindolecarboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 2-(4-ethoxyphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-p-phenetyl-isoindoline-5-carboxylic acid (6-chloro-3-pyridyl)methyl ester Formula: C23H17ClN2O5 MolecularWeight: 436.84448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CN=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CN=C(C=C4)Cl

InChI

InChI=1S/C23H17ClN2O5/c1-2-30-17-7-5-16(6-8-17)26-21(27)18-9-4-15(11-19(18)22(26)28)23(29)31-13-14-3-10-20(24)25-12-14/h3-12H,2,13H2,1H3