N-[(4-methylsulfanylphenyl)methyl]-3-nitro-aniline

Systemtic Name: N-[(4-methylsulfanylphenyl)methyl]-3-nitro-aniline Openeye Name: N-[(4-methylsulfanylphenyl)methyl]-3-nitro-aniline CAS Name: N-[[4-(methylthio)phenyl]methyl]-3-nitroaniline IUPAC Name: N-[(4-methylsulfanylphenyl)methyl]-3-nitroaniline Traditional Name: [4-(methylthio)benzyl]-(3-nitrophenyl)amine Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)CNC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O2S/c1-19-14-7-5-11(6-8-14)10-15-12-3-2-4-13(9-12)16(17)18/h2-9,15H,10H2,1H3