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

Systemtic Name: 2-[4-bromanyl-3-(3-oxidanylidenebutan-2-yloxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-[4-bromo-3-(1-methyl-2-oxo-propoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-bromo-3-(3-oxobutan-2-yloxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-bromo-3-(3-oxobutan-2-yloxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-[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)N2C(=O)C3=C(C2=O)CCCC3)Br

Isomeric SMILES

CC(C(=O)C)OC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)CCCC3)Br

InChI

InChI=1S/C18H18BrNO4/c1-10(21)11(2)24-16-9-12(7-8-15(16)19)20-17(22)13-5-3-4-6-14(13)18(20)23/h7-9,11H,3-6H2,1-2H3