N-[(4-chlorophenyl)sulfanylmethyl]-4-nitro-aniline

Systemtic Name: N-[(4-chlorophenyl)sulfanylmethyl]-4-nitro-aniline Openeye Name: N-[(4-chlorophenyl)sulfanylmethyl]-4-nitro-aniline CAS Name: N-[[(4-chlorophenyl)thio]methyl]-4-nitroaniline IUPAC Name: N-[(4-chlorophenyl)sulfanylmethyl]-4-nitroaniline Traditional Name: [(4-chlorophenyl)thio]methyl-(4-nitrophenyl)amine Formula: C13H11ClN2O2S MolecularWeight: 294.75664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCSC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCSC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClN2O2S/c14-10-1-7-13(8-2-10)19-9-15-11-3-5-12(6-4-11)16(17)18/h1-8,15H,9H2