4-(2-chloroethylsulfanyl)-2-methyl-1-nitro-benzene

Systemtic Name: 4-(2-chloroethylsulfanyl)-2-methyl-1-nitro-benzene Openeye Name: 4-(2-chloroethylsulfanyl)-2-methyl-1-nitro-benzene CAS Name: 4-(2-chloroethylthio)-2-methyl-1-nitrobenzene IUPAC Name: 4-(2-chloroethylsulfanyl)-2-methyl-1-nitrobenzene Traditional Name: 4-(2-chloroethylthio)-2-methyl-1-nitro-benzene Formula: C9H10ClNO2S MolecularWeight: 231.6992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SCCCl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)SCCCl)[N+](=O)[O-]

InChI

InChI=1S/C9H10ClNO2S/c1-7-6-8(14-5-4-10)2-3-9(7)11(12)13/h2-3,6H,4-5H2,1H3