methylbenzene; 2-(1,2-oxazol-5-yl)benzoic acid

Systemtic Name: methylbenzene; 2-(1,2-oxazol-5-yl)benzoic acid Openeye Name: 2-isoxazol-5-ylbenzoic acid; toluene CAS Name: 2-(5-isoxazolyl)benzoic acid; toluene IUPAC Name: 2-(1,2-oxazol-5-yl)benzoic acid; toluene Traditional Name: 2-isoxazol-5-ylbenzoic acid; toluene Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C1=CC=C(C(=C1)C2=CC=NO2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1.C1=CC=C(C(=C1)C2=CC=NO2)C(=O)O

InChI

InChI=1S/C10H7NO3.C7H8/c12-10(13)8-4-2-1-3-7(8)9-5-6-11-14-9;1-7-5-3-2-4-6-7/h1-6H,(H,12,13);2-6H,1H3