2-methoxy-4-[[(4-methylsulfanylphenyl)amino]methyl]-6-nitro-phenol

Systemtic Name: 2-methoxy-4-[[(4-methylsulfanylphenyl)amino]methyl]-6-nitro-phenol Openeye Name: 2-methoxy-4-[(4-methylsulfanylanilino)methyl]-6-nitro-phenol CAS Name: 2-methoxy-4-[[4-(methylthio)anilino]methyl]-6-nitrophenol IUPAC Name: 2-methoxy-4-[(4-methylsulfanylanilino)methyl]-6-nitrophenol Traditional Name: 2-methoxy-4-[[4-(methylthio)anilino]methyl]-6-nitro-phenol Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])CNC2=CC=C(C=C2)SC

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])CNC2=CC=C(C=C2)SC

InChI

InChI=1S/C15H16N2O4S/c1-21-14-8-10(7-13(15(14)18)17(19)20)9-16-11-3-5-12(22-2)6-4-11/h3-8,16,18H,9H2,1-2H3