N-[(2-methoxy-5-nitro-phenyl)methyl]-4-methylsulfanyl-aniline

Systemtic Name: N-[(2-methoxy-5-nitro-phenyl)methyl]-4-methylsulfanyl-aniline Openeye Name: N-[(2-methoxy-5-nitro-phenyl)methyl]-4-methylsulfanyl-aniline CAS Name: N-[(2-methoxy-5-nitrophenyl)methyl]-4-(methylthio)aniline IUPAC Name: N-[(2-methoxy-5-nitrophenyl)methyl]-4-methylsulfanylaniline Traditional Name: (2-methoxy-5-nitro-benzyl)-[4-(methylthio)phenyl]amine Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CNC2=CC=C(C=C2)SC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CNC2=CC=C(C=C2)SC

InChI

InChI=1S/C15H16N2O3S/c1-20-15-8-5-13(17(18)19)9-11(15)10-16-12-3-6-14(21-2)7-4-12/h3-9,16H,10H2,1-2H3