[2-(dimethylcarbamothioyl)-3-methanoyl-5-nitro-phenyl]methyl 2-methylprop-2-enoate

Systemtic Name: [2-(dimethylcarbamothioyl)-3-methanoyl-5-nitro-phenyl]methyl 2-methylprop-2-enoate Openeye Name: [2-(dimethylcarbamothioyl)-3-formyl-5-nitro-phenyl]methyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [2-[dimethylamino(sulfanylidene)methyl]-3-formyl-5-nitrophenyl]methyl ester IUPAC Name: [2-(dimethylcarbamothioyl)-3-formyl-5-nitrophenyl]methyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [2-(dimethylthiocarbamoyl)-3-formyl-5-nitro-benzyl] ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCC1=C(C(=CC(=C1)[N+](=O)[O-])C=O)C(=S)N(C)C

Isomeric SMILES

CC(=C)C(=O)OCC1=C(C(=CC(=C1)[N+](=O)[O-])C=O)C(=S)N(C)C

InChI

InChI=1S/C15H16N2O5S/c1-9(2)15(19)22-8-11-6-12(17(20)21)5-10(7-18)13(11)14(23)16(3)4/h5-7H,1,8H2,2-4H3