3-chloranyl-4-[2-(4-nitrophenyl)ethylsulfanyl]aniline

Systemtic Name: 3-chloranyl-4-[2-(4-nitrophenyl)ethylsulfanyl]aniline Openeye Name: 3-chloro-4-[2-(4-nitrophenyl)ethylsulfanyl]aniline CAS Name: 3-chloro-4-[2-(4-nitrophenyl)ethylthio]aniline IUPAC Name: 3-chloro-4-[2-(4-nitrophenyl)ethylsulfanyl]aniline Traditional Name: [3-chloro-4-[2-(4-nitrophenyl)ethylthio]phenyl]amine Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCSC2=C(C=C(C=C2)N)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCSC2=C(C=C(C=C2)N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H13ClN2O2S/c15-13-9-11(16)3-6-14(13)20-8-7-10-1-4-12(5-2-10)17(18)19/h1-6,9H,7-8,16H2