1-(4-methoxy-3-methylsulfinyl-phenoxy)-3-[4-(4-methoxyphenyl)butan-2-ylamino]propan-2-ol hydrochloride

Systemtic Name: 1-(4-methoxy-3-methylsulfinyl-phenoxy)-3-[4-(4-methoxyphenyl)butan-2-ylamino]propan-2-ol hydrochloride Openeye Name: 1-(4-methoxy-3-methylsulfinyl-phenoxy)-3-[[3-(4-methoxyphenyl)-1-methyl-propyl]amino]propan-2-ol hydrochloride CAS Name: 1-(4-methoxy-3-methylsulfinylphenoxy)-3-[4-(4-methoxyphenyl)butan-2-ylamino]-2-propanol hydrochloride IUPAC Name: 1-(4-methoxy-3-methylsulfinylphenoxy)-3-[4-(4-methoxyphenyl)butan-2-ylamino]propan-2-ol hydrochloride Traditional Name: 1-(4-methoxy-3-methylsulfinyl-phenoxy)-3-[[3-(4-methoxyphenyl)-1-methyl-propyl]amino]propan-2-ol hydrochloride Formula: C22H32ClNO5S MolecularWeight: 458.01118

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)NCC(COC2=CC(=C(C=C2)OC)S(=O)C)O.Cl

Isomeric SMILES

CC(CCC1=CC=C(C=C1)OC)NCC(COC2=CC(=C(C=C2)OC)S(=O)C)O.Cl

InChI

InChI=1S/C22H31NO5S.ClH/c1-16(5-6-17-7-9-19(26-2)10-8-17)23-14-18(24)15-28-20-11-12-21(27-3)22(13-20)29(4)25;/h7-13,16,18,23-24H,5-6,14-15H2,1-4H3;1H