4-methylsulfonyl-N-[(5-nitrofuran-2-yl)methyl]aniline

Systemtic Name: 4-methylsulfonyl-N-[(5-nitrofuran-2-yl)methyl]aniline Openeye Name: 4-methylsulfonyl-N-[(5-nitro-2-furyl)methyl]aniline CAS Name: 4-methylsulfonyl-N-[(5-nitro-2-furanyl)methyl]aniline IUPAC Name: 4-methylsulfonyl-N-[(5-nitrofuran-2-yl)methyl]aniline Traditional Name: (4-mesylphenyl)-[(5-nitro-2-furyl)methyl]amine Formula: C12H12N2O5S MolecularWeight: 296.29908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O5S/c1-20(17,18)11-5-2-9(3-6-11)13-8-10-4-7-12(19-10)14(15)16/h2-7,13H,8H2,1H3