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

Systemtic Name: 3-(3-cyanophenyl)-5-(phenylmethyl)-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 5-benzyl-3-(3-cyanophenyl)-4H-isoxazole-5-carboxylic acid CAS Name: 3-(3-cyanophenyl)-5-(phenylmethyl)-4H-isoxazole-5-carboxylic acid IUPAC Name: 5-benzyl-3-(3-cyanophenyl)-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 5-benzyl-3-(3-cyanophenyl)-2-isoxazoline-5-carboxylic acid Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NOC1(CC2=CC=CC=C2)C(=O)O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1C(=NOC1(CC2=CC=CC=C2)C(=O)O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H14N2O3/c19-12-14-7-4-8-15(9-14)16-11-18(17(21)22,23-20-16)10-13-5-2-1-3-6-13/h1-9H,10-11H2,(H,21,22)