2-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[4-(2-ethoxyethoxy)-3-nitrophenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-(2-ethoxyethoxy)-3-nitrophenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C15H16N2O6S MolecularWeight: 352.36234

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=C(C=C(C=C1)C2=NC(=C(S2)C(=O)O)C)[N+](=O)[O-]

Isomeric SMILES

CCOCCOC1=C(C=C(C=C1)C2=NC(=C(S2)C(=O)O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O6S/c1-3-22-6-7-23-12-5-4-10(8-11(12)17(20)21)14-16-9(2)13(24-14)15(18)19/h4-5,8H,3,6-7H2,1-2H3,(H,18,19)