5-[(4-chloranyl-3-nitro-phenyl)methylsulfanyl]-2,3-dihydro-1H-indene

Systemtic Name: 5-[(4-chloranyl-3-nitro-phenyl)methylsulfanyl]-2,3-dihydro-1H-indene Openeye Name: 5-[(4-chloro-3-nitro-phenyl)methylsulfanyl]indane CAS Name: 5-[(4-chloro-3-nitrophenyl)methylthio]-2,3-dihydro-1H-indene IUPAC Name: 5-[(4-chloro-3-nitrophenyl)methylsulfanyl]-2,3-dihydro-1H-indene Traditional Name: 5-[(4-chloro-3-nitro-benzyl)thio]indane Formula: C16H14ClNO2S MolecularWeight: 319.80586

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClNO2S/c17-15-7-4-11(8-16(15)18(19)20)10-21-14-6-5-12-2-1-3-13(12)9-14/h4-9H,1-3,10H2