3-azanyl-4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoic acid

Systemtic Name: 3-azanyl-4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoic acid Openeye Name: 3-amino-4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoic acid CAS Name: 3-amino-4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoic acid IUPAC Name: 3-amino-4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoic acid Traditional Name: 3-amino-4-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzoic acid Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=C(C=C(C=C3)C(=O)O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=C(C=C(C=C3)C(=O)O)N

InChI

InChI=1S/C19H19N3O3/c1-19(2,3)13-7-4-11(5-8-13)16-21-22-17(25-16)14-9-6-12(18(23)24)10-15(14)20/h4-10H,20H2,1-3H3,(H,23,24)