[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 5-methyl-2-phenyl-1,3-oxazole-4-carboxylate

Systemtic Name: [(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 5-methyl-2-phenyl-1,3-oxazole-4-carboxylate Openeye Name: [(1S)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl] 5-methyl-2-phenyl-oxazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-oxazolecarboxylic acid [(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] 5-methyl-2-phenyl-1,3-oxazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-oxazole-4-carboxylic acid [(1S)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)OC(=O)C2=C(OC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@H](C)OC(=O)C2=C(OC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C22H21NO4/c1-13-10-11-14(2)18(12-13)20(24)16(4)27-22(25)19-15(3)26-21(23-19)17-8-6-5-7-9-17/h5-12,16H,1-4H3/t16-/m0/s1