dimethyl 2-(3-phenylprop-2-ynyl)-2-prop-2-enyl-propanedioate

Systemtic Name: dimethyl 2-(3-phenylprop-2-ynyl)-2-prop-2-enyl-propanedioate Openeye Name: dimethyl 2-allyl-2-(3-phenylprop-2-ynyl)propanedioate CAS Name: 2-(3-phenylprop-2-ynyl)-2-prop-2-enylpropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(3-phenylprop-2-ynyl)-2-prop-2-enylpropanedioate Traditional Name: 2-allyl-2-(3-phenylprop-2-ynyl)malonic acid dimethyl ester Formula: C17H18O4 MolecularWeight: 286.32242

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC=C)(CC#CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C(CC=C)(CC#CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H18O4/c1-4-12-17(15(18)20-2,16(19)21-3)13-8-11-14-9-6-5-7-10-14/h4-7,9-10H,1,12-13H2,2-3H3