butyl 2-(2-nitrophenyl)sulfanylethanoate

Systemtic Name: butyl 2-(2-nitrophenyl)sulfanylethanoate Openeye Name: butyl 2-(2-nitrophenyl)sulfanylacetate CAS Name: 2-[(2-nitrophenyl)thio]acetic acid butyl ester IUPAC Name: butyl 2-(2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(2-nitrophenyl)thio]acetic acid butyl ester Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)CSC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C12H15NO4S/c1-2-3-8-17-12(14)9-18-11-7-5-4-6-10(11)13(15)16/h4-7H,2-3,8-9H2,1H3