N-[(E)-(5-bromanyl-2-fluoranyl-phenyl)methylideneamino]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(E)-(5-bromanyl-2-fluoranyl-phenyl)methylideneamino]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[(E)-(5-bromo-2-fluoro-phenyl)methyleneamino]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[(E)-(5-bromo-2-fluorophenyl)methylideneamino]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(E)-(5-bromo-2-fluorophenyl)methylideneamino]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[(E)-(5-bromo-2-fluoro-benzylidene)amino]-4-methyl-3-nitro-benzenesulfonamide Formula: C14H11BrFN3O4S MolecularWeight: 416.222243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NN=CC2=C(C=CC(=C2)Br)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N/N=C/C2=C(C=CC(=C2)Br)F)[N+](=O)[O-]

InChI

InChI=1S/C14H11BrFN3O4S/c1-9-2-4-12(7-14(9)19(20)21)24(22,23)18-17-8-10-6-11(15)3-5-13(10)16/h2-8,18H,1H3/b17-8+