1-chloranyl-2,5-dimethyl-4-(nitromethylsulfanyl)benzene

Systemtic Name: 1-chloranyl-2,5-dimethyl-4-(nitromethylsulfanyl)benzene Openeye Name: 1-chloro-2,5-dimethyl-4-(nitromethylsulfanyl)benzene CAS Name: 1-chloro-2,5-dimethyl-4-(nitromethylthio)benzene IUPAC Name: 1-chloro-2,5-dimethyl-4-(nitromethylsulfanyl)benzene Traditional Name: 1-chloro-2,5-dimethyl-4-(nitromethylthio)benzene Formula: C9H10ClNO2S MolecularWeight: 231.6992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)SC[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)SC[N+](=O)[O-]

InChI

InChI=1S/C9H10ClNO2S/c1-6-4-9(14-5-11(12)13)7(2)3-8(6)10/h3-4H,5H2,1-2H3