(4S,5S)-3-(4-chlorophenyl)-4-phenyl-4,5-dihydro-1,2-oxazole-5-carboxylic acid

Systemtic Name: (4S,5S)-3-(4-chlorophenyl)-4-phenyl-4,5-dihydro-1,2-oxazole-5-carboxylic acid Openeye Name: (4S,5S)-3-(4-chlorophenyl)-4-phenyl-4,5-dihydroisoxazole-5-carboxylic acid CAS Name: (4S,5S)-3-(4-chlorophenyl)-4-phenyl-4,5-dihydroisoxazole-5-carboxylic acid IUPAC Name: (4S,5S)-3-(4-chlorophenyl)-4-phenyl-4,5-dihydro-1,2-oxazole-5-carboxylic acid Traditional Name: (4S,5S)-3-(4-chlorophenyl)-4-phenyl-2-isoxazoline-5-carboxylic acid Formula: C16H12ClNO3 MolecularWeight: 301.72438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(ON=C2C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2[C@H](ON=C2C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C16H12ClNO3/c17-12-8-6-11(7-9-12)14-13(10-4-2-1-3-5-10)15(16(19)20)21-18-14/h1-9,13,15H,(H,19,20)/t13-,15-/m0/s1