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

Systemtic Name: ethyl 2-[2-nitro-4-(phenylcarbonyl)phenyl]sulfanylethanoate Openeye Name: ethyl 2-(4-benzoyl-2-nitro-phenyl)sulfanylacetate CAS Name: 2-[(4-benzoyl-2-nitrophenyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(4-benzoyl-2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-benzoyl-2-nitro-phenyl)thio]acetic acid ethyl ester Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO5S/c1-2-23-16(19)11-24-15-9-8-13(10-14(15)18(21)22)17(20)12-6-4-3-5-7-12/h3-10H,2,11H2,1H3