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

Systemtic Name: 2-[4-bromanyl-3-(2,2-diethoxycyclopentyl)oxy-phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-[4-bromo-3-(2,2-diethoxycyclopentoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-bromo-3-(2,2-diethoxycyclopentyl)oxyphenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-bromo-3-(2,2-diethoxycyclopentyl)oxyphenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-[4-bromo-3-(2,2-diethoxycyclopentoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C23H28BrNO5 MolecularWeight: 478.37612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCCC1OC2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)Br)OCC

Isomeric SMILES

CCOC1(CCCC1OC2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)Br)OCC

InChI

InChI=1S/C23H28BrNO5/c1-3-28-23(29-4-2)13-7-10-20(23)30-19-14-15(11-12-18(19)24)25-21(26)16-8-5-6-9-17(16)22(25)27/h11-12,14,20H,3-10,13H2,1-2H3