diethyl 2-methyl-2-(1-phenylbut-3-ynyl)propanedioate

Systemtic Name: diethyl 2-methyl-2-(1-phenylbut-3-ynyl)propanedioate Openeye Name: diethyl 2-methyl-2-(1-phenylbut-3-ynyl)propanedioate CAS Name: 2-methyl-2-(1-phenylbut-3-ynyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-methyl-2-(1-phenylbut-3-ynyl)propanedioate Traditional Name: 2-methyl-2-(1-phenylbut-3-ynyl)malonic acid diethyl ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22O4/c1-5-11-15(14-12-9-8-10-13-14)18(4,16(19)21-6-2)17(20)22-7-3/h1,8-10,12-13,15H,6-7,11H2,2-4H3