1-nitro-3-[(3-nitrophenyl)methylsulfanylmethyl]benzene

Systemtic Name: 1-nitro-3-[(3-nitrophenyl)methylsulfanylmethyl]benzene Openeye Name: 1-nitro-3-[(3-nitrophenyl)methylsulfanylmethyl]benzene CAS Name: 1-nitro-3-[[(3-nitrophenyl)methylthio]methyl]benzene IUPAC Name: 1-nitro-3-[(3-nitrophenyl)methylsulfanylmethyl]benzene Traditional Name: 1-nitro-3-[[(3-nitrobenzyl)thio]methyl]benzene Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O4S/c17-15(18)13-5-1-3-11(7-13)9-21-10-12-4-2-6-14(8-12)16(19)20/h1-8H,9-10H2