(phenylmethyl) 4-nitrobenzenecarboximidothioate

Systemtic Name: (phenylmethyl) 4-nitrobenzenecarboximidothioate Openeye Name: benzyl 4-nitrobenzenecarboximidothioate CAS Name: 4-nitrobenzenecarboximidothioic acid (phenylmethyl) ester IUPAC Name: benzyl 4-nitrobenzenecarboximidothioate Traditional Name: 4-nitrobenzenecarboximidothioic acid benzyl ester Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O2S/c15-14(19-10-11-4-2-1-3-5-11)12-6-8-13(9-7-12)16(17)18/h1-9,15H,10H2