N-heptyl-9-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-N-methyl-nonanamide

Systemtic Name: N-heptyl-9-[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-N-methyl-nonanamide Openeye Name: N-heptyl-9-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-N-methyl-nonanamide CAS Name: N-heptyl-9-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-N-methylnonanamide IUPAC Name: N-heptyl-9-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-N-methylnonanamide Traditional Name: N-heptyl-9-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-N-methyl-pelargonamide Formula: C31H43NO3S MolecularWeight: 509.74302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(C)C(=O)CCCCCCCCC1=C(SC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCCCCN(C)C(=O)CCCCCCCCC1=C(SC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C31H43NO3S/c1-3-4-5-10-13-22-32(2)30(35)15-12-9-7-6-8-11-14-28-27-21-20-26(34)23-29(27)36-31(28)24-16-18-25(33)19-17-24/h16-21,23,33-34H,3-15,22H2,1-2H3