tert-butyl 3,5-bis(2-phenylethynyl)-1,4-oxazine-4-carboxylate

Systemtic Name: tert-butyl 3,5-bis(2-phenylethynyl)-1,4-oxazine-4-carboxylate Openeye Name: tert-butyl 3,5-bis(2-phenylethynyl)-1,4-oxazine-4-carboxylate CAS Name: 3,5-bis(2-phenylethynyl)-1,4-oxazine-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3,5-bis(2-phenylethynyl)-1,4-oxazine-4-carboxylate Traditional Name: 3,5-bis(2-phenylethynyl)-1,4-oxazine-4-carboxylic acid tert-butyl ester Formula: C25H21NO3 MolecularWeight: 383.43914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=COC=C1C#CC2=CC=CC=C2)C#CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=COC=C1C#CC2=CC=CC=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C25H21NO3/c1-25(2,3)29-24(27)26-22(16-14-20-10-6-4-7-11-20)18-28-19-23(26)17-15-21-12-8-5-9-13-21/h4-13,18-19H,1-3H3