trimethyl 4-phenylbut-3-yne-1,1,2-tricarboxylate

Systemtic Name: trimethyl 4-phenylbut-3-yne-1,1,2-tricarboxylate Openeye Name: trimethyl 4-phenylbut-3-yne-1,1,2-tricarboxylate CAS Name: 4-phenyl-3-butyne-1,1,2-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl 4-phenylbut-3-yne-1,1,2-tricarboxylate Traditional Name: 4-phenylbut-3-yne-1,1,2-tricarboxylic acid trimethyl ester Formula: C16H16O6 MolecularWeight: 304.29464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O6/c1-20-14(17)12(10-9-11-7-5-4-6-8-11)13(15(18)21-2)16(19)22-3/h4-8,12-13H,1-3H3