5-methoxy-3-[(6-methoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)oxy-(naphthalen-1-ylmethyl)phosphoryl]oxy-3H-2-benzofuran-1-one

Systemtic Name: 5-methoxy-3-[(6-methoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)oxy-(naphthalen-1-ylmethyl)phosphoryl]oxy-3H-2-benzofuran-1-one Openeye Name: 5-methoxy-3-[(6-methoxy-3-oxo-1H-isobenzofuran-1-yl)oxy-(1-naphthylmethyl)phosphoryl]oxy-3H-isobenzofuran-1-one CAS Name: 5-methoxy-3-[(6-methoxy-3-oxo-1H-isobenzofuran-1-yl)oxy-(1-naphthalenylmethyl)phosphoryl]oxy-3H-isobenzofuran-1-one IUPAC Name: 5-methoxy-3-[(6-methoxy-3-oxo-1H-2-benzofuran-1-yl)oxy-(naphthalen-1-ylmethyl)phosphoryl]oxy-3H-2-benzofuran-1-one Traditional Name: 3-[(3-keto-6-methoxy-phthalan-1-yl)oxy-(1-naphthylmethyl)phosphoryl]oxy-5-methoxy-phthalide Formula: C29H23O9P MolecularWeight: 546.461281

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)OC2OP(=O)(CC3=CC=CC4=CC=CC=C43)OC5C6=C(C=CC(=C6)OC)C(=O)O5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)OC2OP(=O)(CC3=CC=CC4=CC=CC=C43)OC5C6=C(C=CC(=C6)OC)C(=O)O5

InChI

InChI=1S/C29H23O9P/c1-33-19-10-12-22-24(14-19)28(35-26(22)30)37-39(32,16-18-8-5-7-17-6-3-4-9-21(17)18)38-29-25-15-20(34-2)11-13-23(25)27(31)36-29/h3-15,28-29H,16H2,1-2H3