1-methoxy-2,4-bis(methylsulfanyl)-5-nitro-benzene

Systemtic Name: 1-methoxy-2,4-bis(methylsulfanyl)-5-nitro-benzene Openeye Name: 1-methoxy-2,4-bis(methylsulfanyl)-5-nitro-benzene CAS Name: 1-methoxy-2,4-bis(methylthio)-5-nitrobenzene IUPAC Name: 1-methoxy-2,4-bis(methylsulfanyl)-5-nitrobenzene Traditional Name: 1-methoxy-2,4-bis(methylthio)-5-nitro-benzene Formula: C9H11NO3S2 MolecularWeight: 245.31854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)[N+](=O)[O-])SC)SC

Isomeric SMILES

COC1=C(C=C(C(=C1)[N+](=O)[O-])SC)SC

InChI

InChI=1S/C9H11NO3S2/c1-13-7-4-6(10(11)12)8(14-2)5-9(7)15-3/h4-5H,1-3H3