1-chloranyl-2,4-dinitro-5-propan-2-ylsulfanyl-benzene

Systemtic Name: 1-chloranyl-2,4-dinitro-5-propan-2-ylsulfanyl-benzene Openeye Name: 1-chloro-5-isopropylsulfanyl-2,4-dinitro-benzene CAS Name: 1-chloro-2,4-dinitro-5-(propan-2-ylthio)benzene IUPAC Name: 1-chloro-2,4-dinitro-5-propan-2-ylsulfanylbenzene Traditional Name: 1-chloro-5-(isopropylthio)-2,4-dinitro-benzene Formula: C9H9ClN2O4S MolecularWeight: 276.69676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)SC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C9H9ClN2O4S/c1-5(2)17-9-3-6(10)7(11(13)14)4-8(9)12(15)16/h3-5H,1-2H3