6-chloranyl-2-[(3-chloranyl-4-methoxy-phenyl)methyl]-3-methyl-5-propyl-1-benzofuran-4,7-dione

Systemtic Name: 6-chloranyl-2-[(3-chloranyl-4-methoxy-phenyl)methyl]-3-methyl-5-propyl-1-benzofuran-4,7-dione Openeye Name: 6-chloro-2-[(3-chloro-4-methoxy-phenyl)methyl]-3-methyl-5-propyl-benzofuran-4,7-dione CAS Name: 6-chloro-2-[(3-chloro-4-methoxyphenyl)methyl]-3-methyl-5-propylbenzofuran-4,7-dione IUPAC Name: 6-chloro-2-[(3-chloro-4-methoxyphenyl)methyl]-3-methyl-5-propyl-1-benzofuran-4,7-dione Traditional Name: 6-chloro-2-(3-chloro-4-methoxy-benzyl)-3-methyl-5-propyl-benzofuran-4,7-quinone Formula: C20H18Cl2O4 MolecularWeight: 393.26052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)C2=C(C1=O)C(=C(O2)CC3=CC(=C(C=C3)OC)Cl)C)Cl

Isomeric SMILES

CCCC1=C(C(=O)C2=C(C1=O)C(=C(O2)CC3=CC(=C(C=C3)OC)Cl)C)Cl

InChI

InChI=1S/C20H18Cl2O4/c1-4-5-12-17(22)19(24)20-16(18(12)23)10(2)15(26-20)9-11-6-7-14(25-3)13(21)8-11/h6-8H,4-5,9H2,1-3H3