ethyl 2-[(4-chloranyl-3-nitro-phenyl)methylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[(4-chloranyl-3-nitro-phenyl)methylsulfanyl]ethanoate Openeye Name: ethyl 2-[(4-chloro-3-nitro-phenyl)methylsulfanyl]acetate CAS Name: 2-[(4-chloro-3-nitrophenyl)methylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-3-nitrophenyl)methylsulfanyl]acetate Traditional Name: 2-[(4-chloro-3-nitro-benzyl)thio]acetic acid ethyl ester Formula: C11H12ClNO4S MolecularWeight: 289.73528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSCC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H12ClNO4S/c1-2-17-11(14)7-18-6-8-3-4-9(12)10(5-8)13(15)16/h3-5H,2,6-7H2,1H3