tert-butyl 2-(3-oxidanylprop-1-ynyl)-3,5-diphenyl-1,4-oxazine-4-carboxylate

Systemtic Name: tert-butyl 2-(3-oxidanylprop-1-ynyl)-3,5-diphenyl-1,4-oxazine-4-carboxylate Openeye Name: tert-butyl 2-(3-hydroxyprop-1-ynyl)-3,5-diphenyl-1,4-oxazine-4-carboxylate CAS Name: 2-(3-hydroxyprop-1-ynyl)-3,5-diphenyl-1,4-oxazine-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-hydroxyprop-1-ynyl)-3,5-diphenyl-1,4-oxazine-4-carboxylate Traditional Name: 2-(3-hydroxyprop-1-ynyl)-3,5-diphenyl-1,4-oxazine-4-carboxylic acid tert-butyl ester Formula: C24H23NO4 MolecularWeight: 389.44372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=COC(=C1C2=CC=CC=C2)C#CCO)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=COC(=C1C2=CC=CC=C2)C#CCO)C3=CC=CC=C3

InChI

InChI=1S/C24H23NO4/c1-24(2,3)29-23(27)25-20(18-11-6-4-7-12-18)17-28-21(15-10-16-26)22(25)19-13-8-5-9-14-19/h4-9,11-14,17,26H,16H2,1-3H3