2-[4-bromanyl-3-[(3E)-3-hydroxyiminobutan-2-yl]oxy-phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[4-bromanyl-3-[(3E)-3-hydroxyiminobutan-2-yl]oxy-phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-[4-bromo-3-[(2E)-2-hydroxyimino-1-methyl-propoxy]phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-bromo-3-[(3E)-3-hydroxyiminobutan-2-yl]oxyphenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-bromo-3-[(3E)-3-hydroxyiminobutan-2-yl]oxyphenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-[4-bromo-3-[(2E)-2-hydroximino-1-methyl-propoxy]phenyl]-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C18H19BrN2O4 MolecularWeight: 407.25846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=NO)C)OC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)CCCC3)Br

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O4/c1-10(20-24)11(2)25-16-9-12(7-8-15(16)19)21-17(22)13-5-3-4-6-14(13)18(21)23/h7-9,11,24H,3-6H2,1-2H3/b20-10+