2-[ethanoyl-[(E)-4-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-2-methyl-but-2-enyl]amino]ethylphosphonic acid

Systemtic Name: 2-[ethanoyl-[(E)-4-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-2-methyl-but-2-enyl]amino]ethylphosphonic acid Openeye Name: 2-[acetyl-[(E)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-2-methyl-but-2-enyl]amino]ethylphosphonic acid CAS Name: 2-[acetyl-[(E)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-2-methylbut-2-enyl]amino]ethylphosphonic acid IUPAC Name: 2-[acetyl-[(E)-4-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-2-methylbut-2-enyl]amino]ethylphosphonic acid Traditional Name: 2-[acetyl-[(E)-4-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-2-methyl-but-2-enyl]amino]ethylphosphonic acid Formula: C19H26NO8P MolecularWeight: 427.385401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CN(CCP(=O)(O)O)C(=O)C)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CN(CCP(=O)(O)O)C(=O)C)OC

InChI

InChI=1S/C19H26NO8P/c1-11(9-20(13(3)21)7-8-29(24,25)26)5-6-14-17(22)16-15(10-28-19(16)23)12(2)18(14)27-4/h5,22H,6-10H2,1-4H3,(H2,24,25,26)/b11-5+