4-bromanyl-N-[1-dibutoxyphosphoryl-3-(4-methylphenyl)sulfonyl-4-oxidanylidene-naphthalen-1-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[1-dibutoxyphosphoryl-3-(4-methylphenyl)sulfonyl-4-oxidanylidene-naphthalen-1-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[1-dibutoxyphosphoryl-4-oxo-3-(p-tolylsulfonyl)-1-naphthyl]benzenesulfonamide CAS Name: 4-bromo-N-[1-dibutoxyphosphoryl-3-(4-methylphenyl)sulfonyl-4-oxo-1-naphthalenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[1-dibutoxyphosphoryl-3-(4-methylphenyl)sulfonyl-4-oxonaphthalen-1-yl]benzenesulfonamide Traditional Name: 4-bromo-N-(1-dibutoxyphosphoryl-4-keto-3-tosyl-1-naphthyl)benzenesulfonamide Formula: C31H35BrNO8PS2 MolecularWeight: 724.619261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(C1(C=C(C(=O)C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)NS(=O)(=O)C4=CC=C(C=C4)Br)OCCCC

Isomeric SMILES

CCCCOP(=O)(C1(C=C(C(=O)C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)NS(=O)(=O)C4=CC=C(C=C4)Br)OCCCC

InChI

InChI=1S/C31H35BrNO8PS2/c1-4-6-20-40-42(35,41-21-7-5-2)31(33-44(38,39)26-18-14-24(32)15-19-26)22-29(30(34)27-10-8-9-11-28(27)31)43(36,37)25-16-12-23(3)13-17-25/h8-19,22,33H,4-7,20-21H2,1-3H3