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

Systemtic Name: S-ethyl 2-(4-methoxy-2-nitro-phenyl)ethanethioate Openeye Name: S-ethyl 2-(4-methoxy-2-nitro-phenyl)ethanethioate CAS Name: 2-(4-methoxy-2-nitrophenyl)ethanethioic acid S-ethyl ester IUPAC Name: S-ethyl 2-(4-methoxy-2-nitrophenyl)ethanethioate Traditional Name: 2-(4-methoxy-2-nitro-phenyl)ethanethioic acid S-ethyl ester Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4S/c1-3-17-11(13)6-8-4-5-9(16-2)7-10(8)12(14)15/h4-5,7H,3,6H2,1-2H3