4-[2-[[1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]ethyl]cyclohexan-1-one hydrochloride

Systemtic Name: 4-[2-[[1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]ethyl]cyclohexan-1-one hydrochloride Openeye Name: 4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]ethyl]cyclohexanone hydrochloride CAS Name: 4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]-1-cyclohexanone hydrochloride IUPAC Name: 4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]cyclohexan-1-one hydrochloride Traditional Name: 4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]ethyl]cyclohexanone hydrochloride Formula: C17H26ClNO3 MolecularWeight: 327.84624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)O)O)NCCC2CCC(=O)CC2.Cl

Isomeric SMILES

CC(C(C1=CC=C(C=C1)O)O)NCCC2CCC(=O)CC2.Cl

InChI

InChI=1S/C17H25NO3.ClH/c1-12(17(21)14-4-8-16(20)9-5-14)18-11-10-13-2-6-15(19)7-3-13;/h4-5,8-9,12-13,17-18,20-21H,2-3,6-7,10-11H2,1H3;1H