5-methoxy-2-(2-oxidanylidenepropyl)-3H-isoindol-1-one

Systemtic Name: 5-methoxy-2-(2-oxidanylidenepropyl)-3H-isoindol-1-one Openeye Name: 2-acetonyl-5-methoxy-isoindolin-1-one CAS Name: 5-methoxy-2-(2-oxopropyl)-3H-isoindol-1-one IUPAC Name: 5-methoxy-2-(2-oxopropyl)-3H-isoindol-1-one Traditional Name: 2-acetonyl-5-methoxy-isoindolin-1-one Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1CC2=C(C1=O)C=CC(=C2)OC

Isomeric SMILES

CC(=O)CN1CC2=C(C1=O)C=CC(=C2)OC

InChI

InChI=1S/C12H13NO3/c1-8(14)6-13-7-9-5-10(16-2)3-4-11(9)12(13)15/h3-5H,6-7H2,1-2H3