methyl 3-(4-nitrophenyl)sulfanylbenzoate

Systemtic Name: methyl 3-(4-nitrophenyl)sulfanylbenzoate Openeye Name: methyl 3-(4-nitrophenyl)sulfanylbenzoate CAS Name: 3-[(4-nitrophenyl)thio]benzoic acid methyl ester IUPAC Name: methyl 3-(4-nitrophenyl)sulfanylbenzoate Traditional Name: 3-[(4-nitrophenyl)thio]benzoic acid methyl ester Formula: C14H11NO4S MolecularWeight: 289.30644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO4S/c1-19-14(16)10-3-2-4-13(9-10)20-12-7-5-11(6-8-12)15(17)18/h2-9H,1H3