4-chloranyl-N,N-bis(cyanomethyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N,N-bis(cyanomethyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N,N-bis(cyanomethyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N,N-bis(cyanomethyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N,N-bis(cyanomethyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N,N-bis(cyanomethyl)-3-nitro-benzenesulfonamide Formula: C10H7ClN4O4S MolecularWeight: 314.70498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N(CC#N)CC#N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N(CC#N)CC#N)[N+](=O)[O-])Cl

InChI

InChI=1S/C10H7ClN4O4S/c11-9-2-1-8(7-10(9)15(16)17)20(18,19)14(5-3-12)6-4-13/h1-2,7H,5-6H2