N-[4-[2-(4-dodecylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]benzamide

Systemtic Name: N-[4-[2-(4-dodecylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]benzamide Openeye Name: N-[4-[2-(4-dodecylphenyl)sulfonylbutanoylamino]-2-hydroxy-phenyl]benzamide CAS Name: N-[4-[[2-(4-dodecylphenyl)sulfonyl-1-oxobutyl]amino]-2-hydroxyphenyl]benzamide IUPAC Name: N-[4-[2-(4-dodecylphenyl)sulfonylbutanoylamino]-2-hydroxyphenyl]benzamide Traditional Name: N-[2-hydroxy-4-[2-(4-laurylphenyl)sulfonylbutanoylamino]phenyl]benzamide Formula: C35H46N2O5S MolecularWeight: 606.81514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)C(CC)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C35H46N2O5S/c1-3-5-6-7-8-9-10-11-12-14-17-27-20-23-30(24-21-27)43(41,42)33(4-2)35(40)36-29-22-25-31(32(38)26-29)37-34(39)28-18-15-13-16-19-28/h13,15-16,18-26,33,38H,3-12,14,17H2,1-2H3,(H,36,40)(H,37,39)