methyl 7a-(2-hydroxyethyl)-1,3-bis(oxidanylidene)-3aH-isoindole-5-carboxylate

Systemtic Name: methyl 7a-(2-hydroxyethyl)-1,3-bis(oxidanylidene)-3aH-isoindole-5-carboxylate Openeye Name: methyl 7a-(2-hydroxyethyl)-1,3-dioxo-3aH-isoindole-5-carboxylate CAS Name: 7a-(2-hydroxyethyl)-1,3-dioxo-3aH-isoindole-5-carboxylic acid methyl ester IUPAC Name: methyl 7a-(2-hydroxyethyl)-1,3-dioxo-3aH-isoindole-5-carboxylate Traditional Name: 7a-(2-hydroxyethyl)-1,3-diketo-3aH-isoindole-5-carboxylic acid methyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2C(=O)NC(=O)C2(C=C1)CCO

Isomeric SMILES

COC(=O)C1=CC2C(=O)NC(=O)C2(C=C1)CCO

InChI

InChI=1S/C12H13NO5/c1-18-10(16)7-2-3-12(4-5-14)8(6-7)9(15)13-11(12)17/h2-3,6,8,14H,4-5H2,1H3,(H,13,15,17)