(4-nitrophenyl)methyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: (4-nitrophenyl)methyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid (4-nitrobenzyl) ester Formula: C15H12N2O6S MolecularWeight: 348.33058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O6S/c18-15(10-24-14-7-5-13(6-8-14)17(21)22)23-9-11-1-3-12(4-2-11)16(19)20/h1-8H,9-10H2