ethyl (4S)-3-methyl-4,5-diphenyl-5H-1,2-oxazole-4-carboxylate; ethyl (5S)-3-methyl-4,5-diphenyl-4H-1,2-oxazole-5-carboxylate

Systemtic Name: ethyl (4S)-3-methyl-4,5-diphenyl-5H-1,2-oxazole-4-carboxylate; ethyl (5S)-3-methyl-4,5-diphenyl-4H-1,2-oxazole-5-carboxylate Openeye Name: ethyl (4S)-3-methyl-4,5-diphenyl-5H-isoxazole-4-carboxylate; ethyl (5S)-3-methyl-4,5-diphenyl-4H-isoxazole-5-carboxylate CAS Name: (4S)-3-methyl-4,5-diphenyl-5H-isoxazole-4-carboxylic acid ethyl ester; (5S)-3-methyl-4,5-diphenyl-4H-isoxazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-3-methyl-4,5-diphenyl-5H-1,2-oxazole-4-carboxylate; ethyl (5S)-3-methyl-4,5-diphenyl-4H-1,2-oxazole-5-carboxylate Traditional Name: (4S)-3-methyl-4,5-diphenyl-2-isoxazoline-4-carboxylic acid ethyl ester; (5S)-3-methyl-4,5-diphenyl-2-isoxazoline-5-carboxylic acid ethyl ester Formula: C38H38N2O6 MolecularWeight: 618.71812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C(=NO1)C)C2=CC=CC=C2)C3=CC=CC=C3.CCOC(=O)C1(C(ON=C1C)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@]1(C(C(=NO1)C)C2=CC=CC=C2)C3=CC=CC=C3.CCOC(=O)[C@@]1(C(ON=C1C)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/2C19H19NO3/c1-3-22-18(21)19(16-12-8-5-9-13-16)14(2)20-23-17(19)15-10-6-4-7-11-15;1-3-22-18(21)19(16-12-8-5-9-13-16)17(14(2)20-23-19)15-10-6-4-7-11-15/h2*4-13,17H,3H2,1-2H3/t2*17?,19-/m11/s1