N-[(1S)-1-(2-fluorophenyl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate

Systemtic Name: N-[(1S)-1-(2-fluorophenyl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate Openeye Name: N-[(1S)-1-(2-fluorophenyl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate CAS Name: N-[(1S)-1-(2-fluorophenyl)ethyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzenecarboximidate IUPAC Name: N-[(1S)-1-(2-fluorophenyl)ethyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzenecarboximidate Traditional Name: N-[(1S)-1-(2-fluorophenyl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzenecarboximidate Formula: C22H19FN3O5S- MolecularWeight: 456.466763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=NC(C)C3=CC=CC=C3F)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=N[C@@H](C)C3=CC=CC=C3F)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H20FN3O5S/c1-14-7-12-18(13-21(14)26(28)29)32(30,31)25-17-10-8-16(9-11-17)22(27)24-15(2)19-5-3-4-6-20(19)23/h3-13,15,25H,1-2H3,(H,24,27)/p-1/t15-/m0/s1