4-[(2-methyl-1,3-thiazol-4-yl)methoxy]-3-nitro-benzoic acid

Systemtic Name: 4-[(2-methyl-1,3-thiazol-4-yl)methoxy]-3-nitro-benzoic acid Openeye Name: 4-[(2-methylthiazol-4-yl)methoxy]-3-nitro-benzoic acid CAS Name: 4-[(2-methyl-4-thiazolyl)methoxy]-3-nitrobenzoic acid IUPAC Name: 4-[(2-methyl-1,3-thiazol-4-yl)methoxy]-3-nitrobenzoic acid Traditional Name: 4-[(2-methylthiazol-4-yl)methoxy]-3-nitro-benzoic acid Formula: C12H10N2O5S MolecularWeight: 294.2832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)COC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]

InChI

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