N-(3-chloranyl-4-ethanoyl-phenyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide

Systemtic Name: N-(3-chloranyl-4-ethanoyl-phenyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide Openeye Name: N-(4-acetyl-3-chloro-phenyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide CAS Name: N-(4-acetyl-3-chlorophenyl)-2-nitro-N-(2-nitrophenyl)sulfonylbenzenesulfonamide IUPAC Name: N-(4-acetyl-3-chlorophenyl)-2-nitro-N-(2-nitrophenyl)sulfonylbenzenesulfonamide Traditional Name: N-(4-acetyl-3-chloro-phenyl)-2-nitro-N-(2-nitrophenyl)sulfonyl-benzenesulfonamide Formula: C20H14ClN3O9S2 MolecularWeight: 539.92286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)N(S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)N(S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C20H14ClN3O9S2/c1-13(25)15-11-10-14(12-16(15)21)24(34(30,31)19-8-4-2-6-17(19)22(26)27)35(32,33)20-9-5-3-7-18(20)23(28)29/h2-12H,1H3