methyl 3-oxidanylidene-2-propyl-1H-isoindole-5-carboxylate

Systemtic Name: methyl 3-oxidanylidene-2-propyl-1H-isoindole-5-carboxylate Openeye Name: methyl 3-oxo-2-propyl-isoindoline-5-carboxylate CAS Name: 3-oxo-2-propyl-1H-isoindole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-oxo-2-propyl-1H-isoindole-5-carboxylate Traditional Name: 3-keto-2-propyl-isoindoline-5-carboxylic acid methyl ester Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2=C(C1=O)C=C(C=C2)C(=O)OC

Isomeric SMILES

CCCN1CC2=C(C1=O)C=C(C=C2)C(=O)OC

InChI

InChI=1S/C13H15NO3/c1-3-6-14-8-10-5-4-9(13(16)17-2)7-11(10)12(14)15/h4-5,7H,3,6,8H2,1-2H3