1-(3-methylphenoxy)-3-(octan-2-ylamino)propan-2-ol hydrochloride

Systemtic Name: 1-(3-methylphenoxy)-3-(octan-2-ylamino)propan-2-ol hydrochloride Openeye Name: 1-(1-methylheptylamino)-3-(3-methylphenoxy)propan-2-ol hydrochloride CAS Name: 1-(3-methylphenoxy)-3-(octan-2-ylamino)-2-propanol hydrochloride IUPAC Name: 1-(3-methylphenoxy)-3-(octan-2-ylamino)propan-2-ol hydrochloride Traditional Name: 1-(1-methylheptylamino)-3-(3-methylphenoxy)propan-2-ol hydrochloride Formula: C18H32ClNO2 MolecularWeight: 329.90518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NCC(COC1=CC=CC(=C1)C)O.Cl

Isomeric SMILES

CCCCCCC(C)NCC(COC1=CC=CC(=C1)C)O.Cl

InChI

InChI=1S/C18H31NO2.ClH/c1-4-5-6-7-10-16(3)19-13-17(20)14-21-18-11-8-9-15(2)12-18;/h8-9,11-12,16-17,19-20H,4-7,10,13-14H2,1-3H3;1H