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

Systemtic Name: 2-[4-bromanyl-3-(2,2-dimethoxycyclopentyl)oxy-phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-[4-bromo-3-(2,2-dimethoxycyclopentoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-bromo-3-(2,2-dimethoxycyclopentyl)oxyphenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-bromo-3-(2,2-dimethoxycyclopentyl)oxyphenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-[4-bromo-3-(2,2-dimethoxycyclopentoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C21H24BrNO5 MolecularWeight: 450.32296

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCCC1OC2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)Br)OC

Isomeric SMILES

COC1(CCCC1OC2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)Br)OC

InChI

InChI=1S/C21H24BrNO5/c1-26-21(27-2)11-5-8-18(21)28-17-12-13(9-10-16(17)22)23-19(24)14-6-3-4-7-15(14)20(23)25/h9-10,12,18H,3-8,11H2,1-2H3