N-[3-(4-tert-butylphenyl)carbonylphenyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-tert-butylphenyl)carbonylphenyl]-2-nitro-benzenesulfonamide Openeye Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-nitro-benzenesulfonamide CAS Name: N-[3-[(4-tert-butylphenyl)-oxomethyl]phenyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-nitrobenzenesulfonamide Traditional Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-nitro-benzenesulfonamide Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O5S/c1-23(2,3)18-13-11-16(12-14-18)22(26)17-7-6-8-19(15-17)24-31(29,30)21-10-5-4-9-20(21)25(27)28/h4-15,24H,1-3H3