2-[(Z)-2-diethoxyphosphoryl-1-ethoxy-6-methyl-1-oxidanyl-3-oxidanylidene-hept-1-en-4-yl]isoindole-1,3-dione

Systemtic Name: 2-[(Z)-2-diethoxyphosphoryl-1-ethoxy-6-methyl-1-oxidanyl-3-oxidanylidene-hept-1-en-4-yl]isoindole-1,3-dione Openeye Name: 2-[(Z)-3-diethoxyphosphoryl-4-ethoxy-4-hydroxy-1-isobutyl-2-oxo-but-3-enyl]isoindoline-1,3-dione CAS Name: 2-[(Z)-2-diethoxyphosphoryl-1-ethoxy-1-hydroxy-6-methyl-3-oxohept-1-en-4-yl]isoindole-1,3-dione IUPAC Name: 2-[(Z)-2-diethoxyphosphoryl-1-ethoxy-1-hydroxy-6-methyl-3-oxohept-1-en-4-yl]isoindole-1,3-dione Traditional Name: 2-[(Z)-3-diethoxyphosphoryl-4-ethoxy-4-hydroxy-1-isobutyl-2-keto-but-3-enyl]isoindoline-1,3-quinone Formula: C22H30NO8P MolecularWeight: 467.449261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C(CC(C)C)N1C(=O)C2=CC=CC=C2C1=O)P(=O)(OCC)OCC)O

Isomeric SMILES

CCO/C(=C(/C(=O)C(CC(C)C)N1C(=O)C2=CC=CC=C2C1=O)\P(=O)(OCC)OCC)/O

InChI

InChI=1S/C22H30NO8P/c1-6-29-22(27)19(32(28,30-7-2)31-8-3)18(24)17(13-14(4)5)23-20(25)15-11-9-10-12-16(15)21(23)26/h9-12,14,17,27H,6-8,13H2,1-5H3/b22-19-