1-(azepan-1-yl)-3-(2-tert-butyl-4-methoxy-phenoxy)propan-2-ol hydrochloride

Systemtic Name: 1-(azepan-1-yl)-3-(2-tert-butyl-4-methoxy-phenoxy)propan-2-ol hydrochloride Openeye Name: 1-(azepan-1-yl)-3-(2-tert-butyl-4-methoxy-phenoxy)propan-2-ol hydrochloride CAS Name: 1-(1-azepanyl)-3-(2-tert-butyl-4-methoxyphenoxy)-2-propanol hydrochloride IUPAC Name: 1-(azepan-1-yl)-3-(2-tert-butyl-4-methoxyphenoxy)propan-2-ol hydrochloride Traditional Name: 1-(azepan-1-yl)-3-(2-tert-butyl-4-methoxy-phenoxy)propan-2-ol hydrochloride Formula: C20H34ClNO3 MolecularWeight: 371.94186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)OC)OCC(CN2CCCCCC2)O.Cl

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)OC)OCC(CN2CCCCCC2)O.Cl

InChI

InChI=1S/C20H33NO3.ClH/c1-20(2,3)18-13-17(23-4)9-10-19(18)24-15-16(22)14-21-11-7-5-6-8-12-21;/h9-10,13,16,22H,5-8,11-12,14-15H2,1-4H3;1H