methyl 2-[4-(dimethylcarbamothioyl)-3-nitro-phenyl]ethanoate

Systemtic Name: methyl 2-[4-(dimethylcarbamothioyl)-3-nitro-phenyl]ethanoate Openeye Name: methyl 2-[4-(dimethylcarbamothioyl)-3-nitro-phenyl]acetate CAS Name: 2-[4-[dimethylamino(sulfanylidene)methyl]-3-nitrophenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(dimethylcarbamothioyl)-3-nitrophenyl]acetate Traditional Name: 2-[4-(dimethylthiocarbamoyl)-3-nitro-phenyl]acetic acid methyl ester Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)C1=C(C=C(C=C1)CC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=S)C1=C(C=C(C=C1)CC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O4S/c1-13(2)12(19)9-5-4-8(7-11(15)18-3)6-10(9)14(16)17/h4-6H,7H2,1-3H3