O1-ethyl O4-(3-phenylprop-2-ynyl) (E)-2-diethoxyphosphorylbut-2-enedioate

Systemtic Name: O1-ethyl O4-(3-phenylprop-2-ynyl) (E)-2-diethoxyphosphorylbut-2-enedioate Openeye Name: O1-ethyl O4-(3-phenylprop-2-ynyl) (E)-2-diethoxyphosphorylbut-2-enedioate CAS Name: (E)-2-diethoxyphosphoryl-2-butenedioic acid O1-ethyl ester O4-(3-phenylprop-2-ynyl) ester IUPAC Name: 1-O-ethyl 4-O-(3-phenylprop-2-ynyl) (E)-2-diethoxyphosphorylbut-2-enedioate Traditional Name: (E)-2-diethoxyphosphorylbut-2-enedioic acid O1-ethyl ester O4-(3-phenylprop-2-ynyl) ester Formula: C19H23O7P MolecularWeight: 394.355481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(=O)OCC#CC1=CC=CC=C1)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)/C(=C\C(=O)OCC#CC1=CC=CC=C1)/P(=O)(OCC)OCC

InChI

InChI=1S/C19H23O7P/c1-4-23-19(21)17(27(22,25-5-2)26-6-3)15-18(20)24-14-10-13-16-11-8-7-9-12-16/h7-9,11-12,15H,4-6,14H2,1-3H3/b17-15+