2-(1-ethanoyl-2-oxidanylidene-3H-indol-6-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(1-ethanoyl-2-oxidanylidene-3H-indol-6-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-(1-acetyl-2-oxo-indolin-6-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-(1-acetyl-2-oxo-3H-indol-6-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(1-acetyl-2-oxo-3H-indol-6-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-(1-acetyl-2-keto-indolin-6-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C18H18N2O4 MolecularWeight: 326.34652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=O)CC2=C1C=C(C=C2)N3C(=O)C4CCCCC4C3=O

Isomeric SMILES

CC(=O)N1C(=O)CC2=C1C=C(C=C2)N3C(=O)C4CCCCC4C3=O

InChI

InChI=1S/C18H18N2O4/c1-10(21)19-15-9-12(7-6-11(15)8-16(19)22)20-17(23)13-4-2-3-5-14(13)18(20)24/h6-7,9,13-14H,2-5,8H2,1H3