O1-ethyl O3-[(E)-2-methoxycarbonyl-3-phenyl-prop-2-enyl] propanedioate

Systemtic Name: O1-ethyl O3-[(E)-2-methoxycarbonyl-3-phenyl-prop-2-enyl] propanedioate Openeye Name: O1-ethyl O3-[(E)-2-methoxycarbonyl-3-phenyl-allyl] propanedioate CAS Name: propanedioic acid O1-ethyl ester O3-[(E)-2-methoxycarbonyl-3-phenylprop-2-enyl] ester IUPAC Name: 1-O-ethyl 3-O-[(E)-2-methoxycarbonyl-3-phenylprop-2-enyl] propanedioate Traditional Name: malonic acid O3-[(E)-2-carbomethoxy-3-phenyl-allyl] ester O1-ethyl ester Formula: C16H18O6 MolecularWeight: 306.31052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)OCC(=CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCOC(=O)CC(=O)OC/C(=C\C1=CC=CC=C1)/C(=O)OC

InChI

InChI=1S/C16H18O6/c1-3-21-14(17)10-15(18)22-11-13(16(19)20-2)9-12-7-5-4-6-8-12/h4-9H,3,10-11H2,1-2H3/b13-9+