5-[4-bromanyl-3-(3-oxidanylidenebutan-2-yloxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 5-[4-bromanyl-3-(3-oxidanylidenebutan-2-yloxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 5-[4-bromo-3-(1-methyl-2-oxo-propoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 5-[4-bromo-3-(3-oxobutan-2-yloxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 5-[4-bromo-3-(3-oxobutan-2-yloxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 5-[4-bromo-3-(2-keto-1-methyl-propoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C18H18BrNO4 MolecularWeight: 392.24382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC1=C(C=CC(=C1)C2CCC3=C(C2)C(=O)NC3=O)Br

Isomeric SMILES

CC(C(=O)C)OC1=C(C=CC(=C1)C2CCC3=C(C2)C(=O)NC3=O)Br

InChI

InChI=1S/C18H18BrNO4/c1-9(21)10(2)24-16-8-12(4-6-15(16)19)11-3-5-13-14(7-11)18(23)20-17(13)22/h4,6,8,10-11H,3,5,7H2,1-2H3,(H,20,22,23)