4,5,6,7-tetrakis(chloranyl)-3-[(Z)-2-(3,4-dimethoxyphenyl)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-3H-2-benzofuran-1-one

Systemtic Name: 4,5,6,7-tetrakis(chloranyl)-3-[(Z)-2-(3,4-dimethoxyphenyl)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-3H-2-benzofuran-1-one Openeye Name: 4,5,6,7-tetrachloro-3-[(Z)-2-(3,4-dimethoxyphenyl)-2-(4-pyrrolidin-1-ylphenyl)vinyl]-3H-isobenzofuran-1-one CAS Name: 4,5,6,7-tetrachloro-3-[(Z)-2-(3,4-dimethoxyphenyl)-2-[4-(1-pyrrolidinyl)phenyl]ethenyl]-3H-isobenzofuran-1-one IUPAC Name: 4,5,6,7-tetrachloro-3-[(Z)-2-(3,4-dimethoxyphenyl)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-3H-2-benzofuran-1-one Traditional Name: 4,5,6,7-tetrachloro-3-[(Z)-2-(3,4-dimethoxyphenyl)-2-(4-pyrrolidinophenyl)vinyl]phthalide Formula: C28H23Cl4NO4 MolecularWeight: 579.29852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)O2)C4=CC=C(C=C4)N5CCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C\C2C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)C(=O)O2)/C4=CC=C(C=C4)N5CCCC5)OC

InChI

InChI=1S/C28H23Cl4NO4/c1-35-19-10-7-16(13-20(19)36-2)18(15-5-8-17(9-6-15)33-11-3-4-12-33)14-21-22-23(28(34)37-21)25(30)27(32)26(31)24(22)29/h5-10,13-14,21H,3-4,11-12H2,1-2H3/b18-14-