2-[5-(2-methylpropanoyl)-2,3-dihydro-1H-inden-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-(2-methylpropanoyl)-2,3-dihydro-1H-inden-2-yl]isoindole-1,3-dione Openeye Name: 2-[5-(2-methylpropanoyl)indan-2-yl]isoindoline-1,3-dione CAS Name: 2-[5-(2-methyl-1-oxopropyl)-2,3-dihydro-1H-inden-2-yl]isoindole-1,3-dione IUPAC Name: 2-[5-(2-methylpropanoyl)-2,3-dihydro-1H-inden-2-yl]isoindole-1,3-dione Traditional Name: 2-(5-isobutyrylindan-2-yl)isoindoline-1,3-quinone Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CC2=C(CC(C2)N3C(=O)C4=CC=CC=C4C3=O)C=C1

Isomeric SMILES

CC(C)C(=O)C1=CC2=C(CC(C2)N3C(=O)C4=CC=CC=C4C3=O)C=C1

InChI

InChI=1S/C21H19NO3/c1-12(2)19(23)14-8-7-13-10-16(11-15(13)9-14)22-20(24)17-5-3-4-6-18(17)21(22)25/h3-9,12,16H,10-11H2,1-2H3