dimethyl 2-[3-(4-chlorophenyl)prop-2-ynyl]-2-prop-2-enyl-propanedioate

Systemtic Name: dimethyl 2-[3-(4-chlorophenyl)prop-2-ynyl]-2-prop-2-enyl-propanedioate Openeye Name: dimethyl 2-allyl-2-[3-(4-chlorophenyl)prop-2-ynyl]propanedioate CAS Name: 2-[3-(4-chlorophenyl)prop-2-ynyl]-2-prop-2-enylpropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[3-(4-chlorophenyl)prop-2-ynyl]-2-prop-2-enylpropanedioate Traditional Name: 2-allyl-2-[3-(4-chlorophenyl)prop-2-ynyl]malonic acid dimethyl ester Formula: C17H17ClO4 MolecularWeight: 320.76748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClO4/c1-4-11-17(15(19)21-2,16(20)22-3)12-5-6-13-7-9-14(18)10-8-13/h4,7-10H,1,11-12H2,2-3H3