dimethyl 2-(2-oxidanylidenepropyl)-2-(3-phenylprop-2-ynyl)propanedioate

Systemtic Name: dimethyl 2-(2-oxidanylidenepropyl)-2-(3-phenylprop-2-ynyl)propanedioate Openeye Name: dimethyl 2-acetonyl-2-(3-phenylprop-2-ynyl)propanedioate CAS Name: 2-(2-oxopropyl)-2-(3-phenylprop-2-ynyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-oxopropyl)-2-(3-phenylprop-2-ynyl)propanedioate Traditional Name: 2-acetonyl-2-(3-phenylprop-2-ynyl)malonic acid dimethyl ester Formula: C17H18O5 MolecularWeight: 302.32182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O5/c1-13(18)12-17(15(19)21-2,16(20)22-3)11-7-10-14-8-5-4-6-9-14/h4-6,8-9H,11-12H2,1-3H3