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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(C)(C)O)C1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O

Isomeric SMILES

CCN(CCCC(C)(C)O)C1=CC(=CC=C1)OCC2=CC(=CC=C2)C(O)O

InChI

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