N-(2-chloroethyl)-4-(4-nitrophenyl)sulfanyl-aniline

Systemtic Name: N-(2-chloroethyl)-4-(4-nitrophenyl)sulfanyl-aniline Openeye Name: N-(2-chloroethyl)-4-(4-nitrophenyl)sulfanyl-aniline CAS Name: N-(2-chloroethyl)-4-[(4-nitrophenyl)thio]aniline IUPAC Name: N-(2-chloroethyl)-4-(4-nitrophenyl)sulfanylaniline Traditional Name: 2-chloroethyl-[4-[(4-nitrophenyl)thio]phenyl]amine Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCCl)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCCCl)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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