1,3-bis(chloranyl)-2-(3-methyl-4-methylsulfanyl-phenoxy)-5-nitro-benzene

Systemtic Name: 1,3-bis(chloranyl)-2-(3-methyl-4-methylsulfanyl-phenoxy)-5-nitro-benzene Openeye Name: 1,3-dichloro-2-(3-methyl-4-methylsulfanyl-phenoxy)-5-nitro-benzene CAS Name: 1,3-dichloro-2-[3-methyl-4-(methylthio)phenoxy]-5-nitrobenzene IUPAC Name: 1,3-dichloro-2-(3-methyl-4-methylsulfanylphenoxy)-5-nitrobenzene Traditional Name: 1,3-dichloro-2-[3-methyl-4-(methylthio)phenoxy]-5-nitro-benzene Formula: C14H11Cl2NO3S MolecularWeight: 344.21304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)SC

InChI

InChI=1S/C14H11Cl2NO3S/c1-8-5-10(3-4-13(8)21-2)20-14-11(15)6-9(17(18)19)7-12(14)16/h3-7H,1-2H3