diethyl 2-[(E)-2-methyl-3-phenyl-prop-2-enyl]-2-prop-2-ynyl-propanedioate

Systemtic Name: diethyl 2-[(E)-2-methyl-3-phenyl-prop-2-enyl]-2-prop-2-ynyl-propanedioate Openeye Name: diethyl 2-[(E)-2-methyl-3-phenyl-allyl]-2-prop-2-ynyl-propanedioate CAS Name: 2-[(E)-2-methyl-3-phenylprop-2-enyl]-2-prop-2-ynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-2-methyl-3-phenylprop-2-enyl]-2-prop-2-ynylpropanedioate Traditional Name: 2-[(E)-2-methyl-3-phenyl-allyl]-2-propargyl-malonic acid diethyl ester Formula: C20H24O4 MolecularWeight: 328.40216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(CC#C)(C/C(=C/C1=CC=CC=C1)/C)C(=O)OCC

InChI

InChI=1S/C20H24O4/c1-5-13-20(18(21)23-6-2,19(22)24-7-3)15-16(4)14-17-11-9-8-10-12-17/h1,8-12,14H,6-7,13,15H2,2-4H3/b16-14+