4-[[[4-(4-hydroxyphenyl)-4-oxidanyl-butan-2-yl]amino]methyl]phenol hydrochloride

Systemtic Name: 4-[[[4-(4-hydroxyphenyl)-4-oxidanyl-butan-2-yl]amino]methyl]phenol hydrochloride Openeye Name: 4-[[[3-hydroxy-3-(4-hydroxyphenyl)-1-methyl-propyl]amino]methyl]phenol hydrochloride CAS Name: 4-[[[4-hydroxy-4-(4-hydroxyphenyl)butan-2-yl]amino]methyl]phenol hydrochloride IUPAC Name: 4-[[[4-hydroxy-4-(4-hydroxyphenyl)butan-2-yl]amino]methyl]phenol hydrochloride Traditional Name: 4-[[[3-hydroxy-3-(4-hydroxyphenyl)-1-methyl-propyl]amino]methyl]phenol hydrochloride Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC=C(C=C1)O)O)NCC2=CC=C(C=C2)O.Cl

Isomeric SMILES

CC(CC(C1=CC=C(C=C1)O)O)NCC2=CC=C(C=C2)O.Cl

InChI

InChI=1S/C17H21NO3.ClH/c1-12(18-11-13-2-6-15(19)7-3-13)10-17(21)14-4-8-16(20)9-5-14;/h2-9,12,17-21H,10-11H2,1H3;1H