2-methoxy-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-4-nitro-aniline

Systemtic Name: 2-methoxy-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-4-nitro-aniline Openeye Name: 2-methoxy-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]-4-nitro-aniline CAS Name: 2-methoxy-N-[[5-[(methylthio)methyl]-2-furanyl]methyl]-4-nitroaniline IUPAC Name: 2-methoxy-N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-4-nitroaniline Traditional Name: (2-methoxy-4-nitro-phenyl)-[[5-[(methylthio)methyl]-2-furyl]methyl]amine Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NCC2=CC=C(O2)CSC

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NCC2=CC=C(O2)CSC

InChI

InChI=1S/C14H16N2O4S/c1-19-14-7-10(16(17)18)3-6-13(14)15-8-11-4-5-12(20-11)9-21-2/h3-7,15H,8-9H2,1-2H3