ethyl 2-[4-(diethylcarbamoyl)-2-nitro-phenyl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-(diethylcarbamoyl)-2-nitro-phenyl]sulfanylethanoate Openeye Name: ethyl 2-[4-(diethylcarbamoyl)-2-nitro-phenyl]sulfanylacetate CAS Name: 2-[[4-[diethylamino(oxo)methyl]-2-nitrophenyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(diethylcarbamoyl)-2-nitrophenyl]sulfanylacetate Traditional Name: 2-[[4-(diethylcarbamoyl)-2-nitro-phenyl]thio]acetic acid ethyl ester Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=C(C=C1)SCC(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=C(C=C1)SCC(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O5S/c1-4-16(5-2)15(19)11-7-8-13(12(9-11)17(20)21)23-10-14(18)22-6-3/h7-9H,4-6,10H2,1-3H3