2-[4-(2-oxidanylidenepropoxy)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[4-(2-oxidanylidenepropoxy)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(4-acetonyloxyphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-(2-oxopropoxy)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-(2-oxopropoxy)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(4-acetonyloxyphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C17H17NO4 MolecularWeight: 299.32118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC=C(C=C1)N2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

CC(=O)COC1=CC=C(C=C1)N2C(=O)C3CC=CCC3C2=O

InChI

InChI=1S/C17H17NO4/c1-11(19)10-22-13-8-6-12(7-9-13)18-16(20)14-4-2-3-5-15(14)17(18)21/h2-3,6-9,14-15H,4-5,10H2,1H3