N-[(2-fluorophenyl)methyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(2-fluorophenyl)methyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(2-fluorophenyl)methyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(2-fluorophenyl)methyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(2-fluorophenyl)methyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: (2-fluorobenzyl)-(4-mesyl-2-nitro-phenyl)amine Formula: C14H13FN2O4S MolecularWeight: 324.327423

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2F)[N+](=O)[O-]

InChI

InChI=1S/C14H13FN2O4S/c1-22(20,21)11-6-7-13(14(8-11)17(18)19)16-9-10-4-2-3-5-12(10)15/h2-8,16H,9H2,1H3