1-chloranyl-3-nitro-2-(phenylmethylsulfanyl)benzene

Systemtic Name: 1-chloranyl-3-nitro-2-(phenylmethylsulfanyl)benzene Openeye Name: 2-benzylsulfanyl-1-chloro-3-nitro-benzene CAS Name: 1-chloro-3-nitro-2-(phenylmethylthio)benzene IUPAC Name: 2-benzylsulfanyl-1-chloro-3-nitrobenzene Traditional Name: 2-(benzylthio)-1-chloro-3-nitro-benzene Formula: C13H10ClNO2S MolecularWeight: 279.742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H10ClNO2S/c14-11-7-4-8-12(15(16)17)13(11)18-9-10-5-2-1-3-6-10/h1-8H,9H2