ethyl 2-(4-morpholin-4-ylcarbonyl-2-nitro-phenyl)sulfanylethanoate

Systemtic Name: ethyl 2-(4-morpholin-4-ylcarbonyl-2-nitro-phenyl)sulfanylethanoate Openeye Name: ethyl 2-[4-(morpholine-4-carbonyl)-2-nitro-phenyl]sulfanylacetate CAS Name: 2-[[4-[4-morpholinyl(oxo)methyl]-2-nitrophenyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(morpholine-4-carbonyl)-2-nitrophenyl]sulfanylacetate Traditional Name: 2-[[4-(morpholine-4-carbonyl)-2-nitro-phenyl]thio]acetic acid ethyl ester Formula: C15H18N2O6S MolecularWeight: 354.37822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=C(C=C1)C(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSC1=C(C=C(C=C1)C(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O6S/c1-2-23-14(18)10-24-13-4-3-11(9-12(13)17(20)21)15(19)16-5-7-22-8-6-16/h3-4,9H,2,5-8,10H2,1H3