2,3-dimethoxy-6-(5-nitro-2,3-dihydro-1,3-benzoxazol-2-yl)benzoic acid

Systemtic Name: 2,3-dimethoxy-6-(5-nitro-2,3-dihydro-1,3-benzoxazol-2-yl)benzoic acid Openeye Name: 2,3-dimethoxy-6-(5-nitro-2,3-dihydro-1,3-benzoxazol-2-yl)benzoic acid CAS Name: 2,3-dimethoxy-6-(5-nitro-2,3-dihydro-1,3-benzoxazol-2-yl)benzoic acid IUPAC Name: 2,3-dimethoxy-6-(5-nitro-2,3-dihydro-1,3-benzoxazol-2-yl)benzoic acid Traditional Name: 2,3-dimethoxy-6-(5-nitro-2,3-dihydro-1,3-benzoxazol-2-yl)benzoic acid Formula: C16H14N2O7 MolecularWeight: 346.29156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2NC3=C(O2)C=CC(=C3)[N+](=O)[O-])C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2NC3=C(O2)C=CC(=C3)[N+](=O)[O-])C(=O)O)OC

InChI

InChI=1S/C16H14N2O7/c1-23-12-6-4-9(13(16(19)20)14(12)24-2)15-17-10-7-8(18(21)22)3-5-11(10)25-15/h3-7,15,17H,1-2H3,(H,19,20)