1-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione

Systemtic Name: 1-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Openeye Name: 1-(4-benzyloxy-3-iodo-5-methoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione CAS Name: 1-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione IUPAC Name: 1-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Traditional Name: 1-(4-benzoxy-3-iodo-5-methoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Formula: C27H27IO7 MolecularWeight: 590.40355

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)CCC(=O)C2=CC(=C(C(=C2)I)OCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)CCC(=O)C2=CC(=C(C(=C2)I)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C27H27IO7/c1-31-23-13-18(12-20(28)26(23)35-16-17-8-6-5-7-9-17)21(29)10-11-22(30)19-14-24(32-2)27(34-4)25(15-19)33-3/h5-9,12-15H,10-11,16H2,1-4H3