ditert-butyl 2,2-bis(3-phenylprop-2-ynyl)propanedioate

Systemtic Name: ditert-butyl 2,2-bis(3-phenylprop-2-ynyl)propanedioate Openeye Name: ditert-butyl 2,2-bis(3-phenylprop-2-ynyl)propanedioate CAS Name: 2,2-bis(3-phenylprop-2-ynyl)propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2,2-bis(3-phenylprop-2-ynyl)propanedioate Traditional Name: 2,2-bis(3-phenylprop-2-ynyl)malonic acid ditert-butyl ester Formula: C29H32O4 MolecularWeight: 444.56198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC#CC1=CC=CC=C1)(CC#CC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CC#CC1=CC=CC=C1)(CC#CC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H32O4/c1-27(2,3)32-25(30)29(26(31)33-28(4,5)6,21-13-19-23-15-9-7-10-16-23)22-14-20-24-17-11-8-12-18-24/h7-12,15-18H,21-22H2,1-6H3