4-(5-nitro-6-oxidanidyl-1,3-benzoxazol-2-yl)benzoate

Systemtic Name: 4-(5-nitro-6-oxidanidyl-1,3-benzoxazol-2-yl)benzoate Openeye Name: 4-(5-nitro-6-oxido-1,3-benzoxazol-2-yl)benzoate CAS Name: 4-(5-nitro-6-oxido-1,3-benzoxazol-2-yl)benzoate IUPAC Name: 4-(5-nitro-6-oxido-1,3-benzoxazol-2-yl)benzoate Traditional Name: 4-(5-nitro-6-oxido-1,3-benzoxazol-2-yl)benzoate Formula: C14H6N2O6-2 MolecularWeight: 298.20724

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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)/p-2