4-(5-nitro-6-oxidanyl-1,3-benzoxazol-2-yl)benzoic acid

Systemtic Name: 4-(5-nitro-6-oxidanyl-1,3-benzoxazol-2-yl)benzoic acid Openeye Name: 4-(6-hydroxy-5-nitro-1,3-benzoxazol-2-yl)benzoic acid CAS Name: 4-(6-hydroxy-5-nitro-1,3-benzoxazol-2-yl)benzoic acid IUPAC Name: 4-(6-hydroxy-5-nitro-1,3-benzoxazol-2-yl)benzoic acid Traditional Name: 4-(6-hydroxy-5-nitro-1,3-benzoxazol-2-yl)benzoic acid Formula: C14H8N2O6 MolecularWeight: 300.22312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=CC(=C(C=C3O2)O)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=CC(=C(C=C3O2)O)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H8N2O6/c17-11-6-12-9(5-10(11)16(20)21)15-13(22-12)7-1-3-8(4-2-7)14(18)19/h1-6,17H,(H,18,19)