(4,5-dimethoxy-2-methyl-phenyl)methyl 5-nitrothiophene-2-carboxylate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 5-nitrothiophene-2-carboxylate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C15H15NO6S MolecularWeight: 337.3477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)C2=CC=C(S2)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)C2=CC=C(S2)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C15H15NO6S/c1-9-6-11(20-2)12(21-3)7-10(9)8-22-15(17)13-4-5-14(23-13)16(18)19/h4-7H,8H2,1-3H3