methyl 3-oxidanylidene-2-(pyridin-4-ylmethyl)-1H-indene-2-carboxylate

Systemtic Name: methyl 3-oxidanylidene-2-(pyridin-4-ylmethyl)-1H-indene-2-carboxylate Openeye Name: methyl 1-oxo-2-(4-pyridylmethyl)indane-2-carboxylate CAS Name: 3-oxo-2-(pyridin-4-ylmethyl)-1H-indene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-oxo-2-(pyridin-4-ylmethyl)-1H-indene-2-carboxylate Traditional Name: 1-keto-2-(4-pyridylmethyl)indane-2-carboxylic acid methyl ester Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC2=CC=CC=C2C1=O)CC3=CC=NC=C3

Isomeric SMILES

COC(=O)C1(CC2=CC=CC=C2C1=O)CC3=CC=NC=C3

InChI

InChI=1S/C17H15NO3/c1-21-16(20)17(10-12-6-8-18-9-7-12)11-13-4-2-3-5-14(13)15(17)19/h2-9H,10-11H2,1H3