4,4-bis(chloranyl)-5-(phenylmethyl)-5H-1,2-oxazole-3-carboxylic acid

Systemtic Name: 4,4-bis(chloranyl)-5-(phenylmethyl)-5H-1,2-oxazole-3-carboxylic acid Openeye Name: 5-benzyl-4,4-dichloro-5H-isoxazole-3-carboxylic acid CAS Name: 4,4-dichloro-5-(phenylmethyl)-5H-isoxazole-3-carboxylic acid IUPAC Name: 5-benzyl-4,4-dichloro-5H-1,2-oxazole-3-carboxylic acid Traditional Name: 5-benzyl-4,4-dichloro-2-isoxazoline-3-carboxylic acid Formula: C11H9Cl2NO3 MolecularWeight: 274.10006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(C(=NO2)C(=O)O)(Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2C(C(=NO2)C(=O)O)(Cl)Cl

InChI

InChI=1S/C11H9Cl2NO3/c12-11(13)8(17-14-9(11)10(15)16)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,15,16)