S-(4-methylphenyl) 2-(4-nitrophenoxy)ethanethioate

Systemtic Name: S-(4-methylphenyl) 2-(4-nitrophenoxy)ethanethioate Openeye Name: S-(p-tolyl) 2-(4-nitrophenoxy)ethanethioate CAS Name: 2-(4-nitrophenoxy)ethanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-(4-nitrophenoxy)ethanethioate Traditional Name: 2-(4-nitrophenoxy)ethanethioic acid S-(p-tolyl) ester Formula: C15H13NO4S MolecularWeight: 303.33302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO4S/c1-11-2-8-14(9-3-11)21-15(17)10-20-13-6-4-12(5-7-13)16(18)19/h2-9H,10H2,1H3