(phenylmethyl) (4S)-2-(4-methoxyphenyl)-4-(2-methylpropyl)-5-oxidanylidene-1,3-oxazole-4-carboxylate

Systemtic Name: (phenylmethyl) (4S)-2-(4-methoxyphenyl)-4-(2-methylpropyl)-5-oxidanylidene-1,3-oxazole-4-carboxylate Openeye Name: benzyl (4S)-4-isobutyl-2-(4-methoxyphenyl)-5-oxo-oxazole-4-carboxylate CAS Name: (4S)-2-(4-methoxyphenyl)-4-(2-methylpropyl)-5-oxo-4-oxazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-2-(4-methoxyphenyl)-4-(2-methylpropyl)-5-oxo-1,3-oxazole-4-carboxylate Traditional Name: (4S)-4-isobutyl-5-keto-2-(4-methoxyphenyl)-2-oxazoline-4-carboxylic acid benzyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C(=O)OC(=N1)C2=CC=C(C=C2)OC)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@@]1(C(=O)OC(=N1)C2=CC=C(C=C2)OC)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H23NO5/c1-15(2)13-22(20(24)27-14-16-7-5-4-6-8-16)21(25)28-19(23-22)17-9-11-18(26-3)12-10-17/h4-12,15H,13-14H2,1-3H3/t22-/m0/s1