3-[6,7-dimethyl-1,3-bis(oxidanylidene)-7aH-isoindol-3a-yl]propanal

Systemtic Name: 3-[6,7-dimethyl-1,3-bis(oxidanylidene)-7aH-isoindol-3a-yl]propanal Openeye Name: 3-(6,7-dimethyl-1,3-dioxo-7aH-isoindol-3a-yl)propanal CAS Name: 3-(6,7-dimethyl-1,3-dioxo-7aH-isoindol-3a-yl)propanal IUPAC Name: 3-(6,7-dimethyl-1,3-dioxo-7aH-isoindol-3a-yl)propanal Traditional Name: 3-(1,3-diketo-6,7-dimethyl-7aH-isoindol-3a-yl)propionaldehyde Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2C(=O)NC(=O)C2(C=C1)CCC=O)C

Isomeric SMILES

CC1=C(C2C(=O)NC(=O)C2(C=C1)CCC=O)C

InChI

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