N,N-diethyl-4-[(2-fluorophenyl)methylsulfonyl]-3-nitro-benzamide

Systemtic Name: N,N-diethyl-4-[(2-fluorophenyl)methylsulfonyl]-3-nitro-benzamide Openeye Name: N,N-diethyl-4-[(2-fluorophenyl)methylsulfonyl]-3-nitro-benzamide CAS Name: N,N-diethyl-4-[(2-fluorophenyl)methylsulfonyl]-3-nitrobenzamide IUPAC Name: N,N-diethyl-4-[(2-fluorophenyl)methylsulfonyl]-3-nitrobenzamide Traditional Name: N,N-diethyl-4-(2-fluorobenzyl)sulfonyl-3-nitro-benzamide Formula: C18H19FN2O5S MolecularWeight: 394.417263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=C(C=C1)S(=O)(=O)CC2=CC=CC=C2F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=C(C=C1)S(=O)(=O)CC2=CC=CC=C2F)[N+](=O)[O-]

InChI

InChI=1S/C18H19FN2O5S/c1-3-20(4-2)18(22)13-9-10-17(16(11-13)21(23)24)27(25,26)12-14-7-5-6-8-15(14)19/h5-11H,3-4,12H2,1-2H3