S-ethyl 2-(4-chloranyl-2-nitro-phenyl)ethanethioate

Systemtic Name: S-ethyl 2-(4-chloranyl-2-nitro-phenyl)ethanethioate Openeye Name: S-ethyl 2-(4-chloro-2-nitro-phenyl)ethanethioate CAS Name: 2-(4-chloro-2-nitrophenyl)ethanethioic acid S-ethyl ester IUPAC Name: S-ethyl 2-(4-chloro-2-nitrophenyl)ethanethioate Traditional Name: 2-(4-chloro-2-nitro-phenyl)ethanethioic acid S-ethyl ester Formula: C10H10ClNO3S MolecularWeight: 259.7093

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCSC(=O)CC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H10ClNO3S/c1-2-16-10(13)5-7-3-4-8(11)6-9(7)12(14)15/h3-4,6H,2,5H2,1H3