5-[(4-methyl-2-nitro-phenoxy)methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(4-methyl-2-nitro-phenoxy)methyl]thiophene-2-carboxylic acid Openeye Name: 5-[(4-methyl-2-nitro-phenoxy)methyl]thiophene-2-carboxylic acid CAS Name: 5-[(4-methyl-2-nitrophenoxy)methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(4-methyl-2-nitrophenoxy)methyl]thiophene-2-carboxylic acid Traditional Name: 5-[(4-methyl-2-nitro-phenoxy)methyl]-2-thenoic acid Formula: C13H11NO5S MolecularWeight: 293.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=C(S2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=C(S2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H11NO5S/c1-8-2-4-11(10(6-8)14(17)18)19-7-9-3-5-12(20-9)13(15)16/h2-6H,7H2,1H3,(H,15,16)