4-bromanyl-N-[2,3-dimethyl-4-oxidanyl-5-(phenylsulfonyl)phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[2,3-dimethyl-4-oxidanyl-5-(phenylsulfonyl)phenyl]benzamide Openeye Name: N-[5-(benzenesulfonyl)-4-hydroxy-2,3-dimethyl-phenyl]-4-bromo-benzamide CAS Name: N-[5-(benzenesulfonyl)-4-hydroxy-2,3-dimethylphenyl]-4-bromobenzamide IUPAC Name: N-[5-(benzenesulfonyl)-4-hydroxy-2,3-dimethylphenyl]-4-bromobenzamide Traditional Name: N-(5-besyl-4-hydroxy-2,3-dimethyl-phenyl)-4-bromo-benzamide Formula: C21H18BrNO4S MolecularWeight: 460.34092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1NC(=O)C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1NC(=O)C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3)O)C

InChI

InChI=1S/C21H18BrNO4S/c1-13-14(2)20(24)19(28(26,27)17-6-4-3-5-7-17)12-18(13)23-21(25)15-8-10-16(22)11-9-15/h3-12,24H,1-2H3,(H,23,25)