diethyl 2-[(E,5S)-4-methyl-5-phenoxycarbonyloxy-hex-3-enyl]propanedioate

Systemtic Name: diethyl 2-[(E,5S)-4-methyl-5-phenoxycarbonyloxy-hex-3-enyl]propanedioate Openeye Name: diethyl 2-[(E,5S)-4-methyl-5-phenoxycarbonyloxy-hex-3-enyl]propanedioate CAS Name: 2-[(E,5S)-4-methyl-5-[oxo(phenoxy)methoxy]hex-3-enyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E,5S)-4-methyl-5-phenoxycarbonyloxyhex-3-enyl]propanedioate Traditional Name: 2-[(E,5S)-5-carbophenoxyoxy-4-methyl-hex-3-enyl]malonic acid diethyl ester Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC=C(C)C(C)OC(=O)OC1=CC=CC=C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC/C=C(\C)/[C@H](C)OC(=O)OC1=CC=CC=C1)C(=O)OCC

InChI

InChI=1S/C21H28O7/c1-5-25-19(22)18(20(23)26-6-2)14-10-11-15(3)16(4)27-21(24)28-17-12-8-7-9-13-17/h7-9,11-13,16,18H,5-6,10,14H2,1-4H3/b15-11+/t16-/m0/s1