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

Systemtic Name: 4-bromanyl-N-[1-dipentoxyphosphoryl-3-(4-methylphenyl)sulfonyl-4-oxidanylidene-naphthalen-1-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[1-dipentoxyphosphoryl-4-oxo-3-(p-tolylsulfonyl)-1-naphthyl]benzenesulfonamide CAS Name: 4-bromo-N-[1-dipentoxyphosphoryl-3-(4-methylphenyl)sulfonyl-4-oxo-1-naphthalenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[1-dipentoxyphosphoryl-3-(4-methylphenyl)sulfonyl-4-oxonaphthalen-1-yl]benzenesulfonamide Traditional Name: 4-bromo-N-(1-diamoxyphosphoryl-4-keto-3-tosyl-1-naphthyl)benzenesulfonamide Formula: C33H39BrNO8PS2 MolecularWeight: 752.672421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOP(=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)OCCCCC

Isomeric SMILES

CCCCCOP(=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)OCCCCC

InChI

InChI=1S/C33H39BrNO8PS2/c1-4-6-10-22-42-44(37,43-23-11-7-5-2)33(35-46(40,41)28-20-16-26(34)17-21-28)24-31(32(36)29-12-8-9-13-30(29)33)45(38,39)27-18-14-25(3)15-19-27/h8-9,12-21,24,35H,4-7,10-11,22-23H2,1-3H3