2-[[3,5-bis(chloranyl)-4-methoxy-phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3,5-bis(chloranyl)-4-methoxy-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[(3,5-dichloro-4-methoxy-phenyl)methyl]isoindoline-1,3-dione CAS Name: 2-[(3,5-dichloro-4-methoxyphenyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(3,5-dichloro-4-methoxyphenyl)methyl]isoindole-1,3-dione Traditional Name: 2-(3,5-dichloro-4-methoxy-benzyl)isoindoline-1,3-quinone Formula: C16H11Cl2NO3 MolecularWeight: 336.16944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)CN2C(=O)C3=CC=CC=C3C2=O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1Cl)CN2C(=O)C3=CC=CC=C3C2=O)Cl

InChI

InChI=1S/C16H11Cl2NO3/c1-22-14-12(17)6-9(7-13(14)18)8-19-15(20)10-4-2-3-5-11(10)16(19)21/h2-7H,8H2,1H3