methyl 2-butyl-3-[4-[2-(dibutylamino)-1-oxidanyl-ethyl]phenyl]carbonyl-1-benzofuran-5-carboxylate

Systemtic Name: methyl 2-butyl-3-[4-[2-(dibutylamino)-1-oxidanyl-ethyl]phenyl]carbonyl-1-benzofuran-5-carboxylate Openeye Name: methyl 2-butyl-3-[4-[2-(dibutylamino)-1-hydroxy-ethyl]benzoyl]benzofuran-5-carboxylate CAS Name: 2-butyl-3-[[4-[2-(dibutylamino)-1-hydroxyethyl]phenyl]-oxomethyl]-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-butyl-3-[4-[2-(dibutylamino)-1-hydroxyethyl]benzoyl]-1-benzofuran-5-carboxylate Traditional Name: 2-butyl-3-[4-[2-(dibutylamino)-1-hydroxy-ethyl]benzoyl]benzofuran-5-carboxylic acid methyl ester Formula: C31H41NO5 MolecularWeight: 507.66094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC)C(=O)C3=CC=C(C=C3)C(CN(CCCC)CCCC)O

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC)C(=O)C3=CC=C(C=C3)C(CN(CCCC)CCCC)O

InChI

InChI=1S/C31H41NO5/c1-5-8-11-28-29(25-20-24(31(35)36-4)16-17-27(25)37-28)30(34)23-14-12-22(13-15-23)26(33)21-32(18-9-6-2)19-10-7-3/h12-17,20,26,33H,5-11,18-19,21H2,1-4H3