N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-cyclopropyl-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-cyclopropyl-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-N-cyclopropyl-2-methoxy-5-nitro-benzenesulfonamide CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopropyl-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopropyl-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: N-(2-chloro-6-fluoro-benzyl)-N-cyclopropyl-2-methoxy-5-nitro-benzenesulfonamide Formula: C17H16ClFN2O5S MolecularWeight: 414.835743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)C3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)C3CC3

InChI

InChI=1S/C17H16ClFN2O5S/c1-26-16-8-7-12(21(22)23)9-17(16)27(24,25)20(11-5-6-11)10-13-14(18)3-2-4-15(13)19/h2-4,7-9,11H,5-6,10H2,1H3