2-[4-(4-methoxy-3-nitro-phenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(4-methoxy-3-nitro-phenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(4-methoxy-3-nitro-phenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(4-methoxy-3-nitrophenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(4-methoxy-3-nitrophenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(4-methoxy-3-nitro-phenyl)thiazol-2-yl]acetic acid Formula: C12H10N2O5S MolecularWeight: 294.2832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O5S/c1-19-10-3-2-7(4-9(10)14(17)18)8-6-20-11(13-8)5-12(15)16/h2-4,6H,5H2,1H3,(H,15,16)