[3-[[3-[(4-ethyl-4-oxidanyl-hexyl)-methyl-amino]phenoxy]methyl]phenyl]methanediol

Systemtic Name: [3-[[3-[(4-ethyl-4-oxidanyl-hexyl)-methyl-amino]phenoxy]methyl]phenyl]methanediol Openeye Name: [3-[[3-[(4-ethyl-4-hydroxy-hexyl)-methyl-amino]phenoxy]methyl]phenyl]methanediol CAS Name: [3-[[3-[(4-ethyl-4-hydroxyhexyl)-methylamino]phenoxy]methyl]phenyl]methanediol IUPAC Name: [3-[[3-[(4-ethyl-4-hydroxyhexyl)-methylamino]phenoxy]methyl]phenyl]methanediol Traditional Name: [3-[[3-[(4-ethyl-4-hydroxy-hexyl)-methyl-amino]phenoxy]methyl]phenyl]methanediol Formula: C23H33NO4 MolecularWeight: 387.51242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCN(C)C1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O)O

Isomeric SMILES

CCC(CC)(CCCN(C)C1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O)O

InChI

InChI=1S/C23H33NO4/c1-4-23(27,5-2)13-8-14-24(3)20-11-7-12-21(16-20)28-17-18-9-6-10-19(15-18)22(25)26/h6-7,9-12,15-16,22,25-27H,4-5,8,13-14,17H2,1-3H3