1-chloranyl-4-nitro-2-[(4-propan-2-ylphenyl)sulfanylmethyl]benzene

Systemtic Name: 1-chloranyl-4-nitro-2-[(4-propan-2-ylphenyl)sulfanylmethyl]benzene Openeye Name: 1-chloro-2-[(4-isopropylphenyl)sulfanylmethyl]-4-nitro-benzene CAS Name: 1-chloro-4-nitro-2-[[(4-propan-2-ylphenyl)thio]methyl]benzene IUPAC Name: 1-chloro-4-nitro-2-[(4-propan-2-ylphenyl)sulfanylmethyl]benzene Traditional Name: 1-chloro-4-nitro-2-[(p-cumenylthio)methyl]benzene Formula: C16H16ClNO2S MolecularWeight: 321.82174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H16ClNO2S/c1-11(2)12-3-6-15(7-4-12)21-10-13-9-14(18(19)20)5-8-16(13)17/h3-9,11H,10H2,1-2H3