N-[3-(4-chlorophenyl)sulfonyl-4-oxidanyl-5-propan-2-yl-phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfonyl-4-oxidanyl-5-propan-2-yl-phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-5-isopropyl-phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-5-propan-2-ylphenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-5-propan-2-ylphenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-5-isopropyl-phenyl]-3-nitro-benzenesulfonamide Formula: C21H19ClN2O7S2 MolecularWeight: 510.96776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1O)S(=O)(=O)C2=CC=C(C=C2)Cl)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=CC(=C1O)S(=O)(=O)C2=CC=C(C=C2)Cl)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H19ClN2O7S2/c1-13(2)19-10-15(23-33(30,31)18-5-3-4-16(12-18)24(26)27)11-20(21(19)25)32(28,29)17-8-6-14(22)7-9-17/h3-13,23,25H,1-2H3