4-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]benzoic acid Openeye Name: 4-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]benzoic acid CAS Name: 4-[[oxo-(3-phenyl-2,1-benzoxazol-5-yl)methyl]amino]benzoic acid IUPAC Name: 4-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]benzoic acid Traditional Name: 4-[(3-phenylanthranil-5-carbonyl)amino]benzoic acid Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C21H14N2O4/c24-20(22-16-9-6-14(7-10-16)21(25)26)15-8-11-18-17(12-15)19(27-23-18)13-4-2-1-3-5-13/h1-12H,(H,22,24)(H,25,26)