3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-2,2-diphenyl-hex-4-ynoic acid

Systemtic Name: 3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-2,2-diphenyl-hex-4-ynoic acid Openeye Name: 3-(5-methyl-2-phenyl-oxazol-4-yl)-2,2-diphenyl-hex-4-ynoic acid CAS Name: 3-(5-methyl-2-phenyl-4-oxazolyl)-2,2-diphenyl-4-hexynoic acid IUPAC Name: 3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-2,2-diphenylhex-4-ynoic acid Traditional Name: 3-(5-methyl-2-phenyl-oxazol-4-yl)-2,2-diphenyl-hex-4-ynoic acid Formula: C28H23NO3 MolecularWeight: 421.48712

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C1=C(OC(=N1)C2=CC=CC=C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC#CC(C1=C(OC(=N1)C2=CC=CC=C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H23NO3/c1-3-13-24(25-20(2)32-26(29-25)21-14-7-4-8-15-21)28(27(30)31,22-16-9-5-10-17-22)23-18-11-6-12-19-23/h4-12,14-19,24H,1-2H3,(H,30,31)