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

Systemtic Name: [3-[[3-[(4-ethyl-4-oxidanyl-hexyl)amino]phenoxy]methyl]phenyl]methanediol Openeye Name: [3-[[3-[(4-ethyl-4-hydroxy-hexyl)amino]phenoxy]methyl]phenyl]methanediol CAS Name: [3-[[3-[(4-ethyl-4-hydroxyhexyl)amino]phenoxy]methyl]phenyl]methanediol IUPAC Name: [3-[[3-[(4-ethyl-4-hydroxyhexyl)amino]phenoxy]methyl]phenyl]methanediol Traditional Name: [3-[[3-[(4-ethyl-4-hydroxy-hexyl)amino]phenoxy]methyl]phenyl]methanediol Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCNC1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O)O

Isomeric SMILES

CCC(CC)(CCCNC1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O)O

InChI

InChI=1S/C22H31NO4/c1-3-22(26,4-2)12-7-13-23-19-10-6-11-20(15-19)27-16-17-8-5-9-18(14-17)21(24)25/h5-6,8-11,14-15,21,23-26H,3-4,7,12-13,16H2,1-2H3