5-methoxy-2-nitro-4-(thiophen-2-ylmethoxy)benzoic acid

Systemtic Name: 5-methoxy-2-nitro-4-(thiophen-2-ylmethoxy)benzoic acid Openeye Name: 5-methoxy-2-nitro-4-(2-thienylmethoxy)benzoic acid CAS Name: 5-methoxy-2-nitro-4-(thiophen-2-ylmethoxy)benzoic acid IUPAC Name: 5-methoxy-2-nitro-4-(thiophen-2-ylmethoxy)benzoic acid Traditional Name: 5-methoxy-2-nitro-4-(2-thenyloxy)benzoic acid Formula: C13H11NO6S MolecularWeight: 309.29454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)[N+](=O)[O-])OCC2=CC=CS2

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)[N+](=O)[O-])OCC2=CC=CS2

InChI

InChI=1S/C13H11NO6S/c1-19-11-5-9(13(15)16)10(14(17)18)6-12(11)20-7-8-3-2-4-21-8/h2-6H,7H2,1H3,(H,15,16)