methyl 2-[3-oxidanylidene-2-(pyridin-4-ylmethyl)-1H-isoindol-1-yl]ethanoate

Systemtic Name: methyl 2-[3-oxidanylidene-2-(pyridin-4-ylmethyl)-1H-isoindol-1-yl]ethanoate Openeye Name: methyl 2-[3-oxo-2-(4-pyridylmethyl)isoindolin-1-yl]acetate CAS Name: 2-[3-oxo-2-(pyridin-4-ylmethyl)-1H-isoindol-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-oxo-2-(pyridin-4-ylmethyl)-1H-isoindol-1-yl]acetate Traditional Name: 2-[3-keto-2-(4-pyridylmethyl)isoindolin-1-yl]acetic acid methyl ester Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C2=CC=CC=C2C(=O)N1CC3=CC=NC=C3

Isomeric SMILES

COC(=O)CC1C2=CC=CC=C2C(=O)N1CC3=CC=NC=C3

InChI

InChI=1S/C17H16N2O3/c1-22-16(20)10-15-13-4-2-3-5-14(13)17(21)19(15)11-12-6-8-18-9-7-12/h2-9,15H,10-11H2,1H3