N-[2-(4-butan-2-yloxyphenoxy)-4-methanoyl-5-oxidanyl-phenyl]-2-(4-methylphenyl)sulfonyl-butanamide

Systemtic Name: N-[2-(4-butan-2-yloxyphenoxy)-4-methanoyl-5-oxidanyl-phenyl]-2-(4-methylphenyl)sulfonyl-butanamide Openeye Name: N-[4-formyl-5-hydroxy-2-(4-sec-butoxyphenoxy)phenyl]-2-(p-tolylsulfonyl)butanamide CAS Name: N-[2-(4-butan-2-yloxyphenoxy)-4-formyl-5-hydroxyphenyl]-2-(4-methylphenyl)sulfonylbutanamide IUPAC Name: N-[2-(4-butan-2-yloxyphenoxy)-4-formyl-5-hydroxyphenyl]-2-(4-methylphenyl)sulfonylbutanamide Traditional Name: N-[4-formyl-5-hydroxy-2-(4-sec-butoxyphenoxy)phenyl]-2-tosyl-butyramide Formula: C28H31NO7S MolecularWeight: 525.61324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)OC2=C(C=C(C(=C2)C=O)O)NC(=O)C(CC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)OC2=C(C=C(C(=C2)C=O)O)NC(=O)C(CC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C28H31NO7S/c1-5-19(4)35-21-9-11-22(12-10-21)36-26-15-20(17-30)25(31)16-24(26)29-28(32)27(6-2)37(33,34)23-13-7-18(3)8-14-23/h7-17,19,27,31H,5-6H2,1-4H3,(H,29,32)