1-chloranyl-4-(2-nitro-1-phenyl-ethyl)sulfanyl-benzene

Systemtic Name: 1-chloranyl-4-(2-nitro-1-phenyl-ethyl)sulfanyl-benzene Openeye Name: 1-chloro-4-(2-nitro-1-phenyl-ethyl)sulfanyl-benzene CAS Name: 1-chloro-4-[(2-nitro-1-phenylethyl)thio]benzene IUPAC Name: 1-chloro-4-(2-nitro-1-phenylethyl)sulfanylbenzene Traditional Name: 1-chloro-4-[(2-nitro-1-phenyl-ethyl)thio]benzene Formula: C14H12ClNO2S MolecularWeight: 293.76858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[N+](=O)[O-])SC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C[N+](=O)[O-])SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H12ClNO2S/c15-12-6-8-13(9-7-12)19-14(10-16(17)18)11-4-2-1-3-5-11/h1-9,14H,10H2