2-[3-[2-(2-methylphenyl)propylamino]-2-oxidanyl-propoxy]-1,3-diphenyl-propan-1-one hydrochloride

Systemtic Name: 2-[3-[2-(2-methylphenyl)propylamino]-2-oxidanyl-propoxy]-1,3-diphenyl-propan-1-one hydrochloride Openeye Name: 2-[2-hydroxy-3-[2-(o-tolyl)propylamino]propoxy]-1,3-diphenyl-propan-1-one hydrochloride CAS Name: 2-[2-hydroxy-3-[2-(2-methylphenyl)propylamino]propoxy]-1,3-diphenyl-1-propanone hydrochloride IUPAC Name: 2-[2-hydroxy-3-[2-(2-methylphenyl)propylamino]propoxy]-1,3-diphenylpropan-1-one hydrochloride Traditional Name: 2-[2-hydroxy-3-[2-(o-tolyl)propylamino]propoxy]-1,3-diphenyl-propan-1-one hydrochloride Formula: C28H34ClNO3 MolecularWeight: 468.02746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)CNCC(COC(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3)O.Cl

Isomeric SMILES

CC1=CC=CC=C1C(C)CNCC(COC(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3)O.Cl

InChI

InChI=1S/C28H33NO3.ClH/c1-21-11-9-10-16-26(21)22(2)18-29-19-25(30)20-32-27(17-23-12-5-3-6-13-23)28(31)24-14-7-4-8-15-24;/h3-16,22,25,27,29-30H,17-20H2,1-2H3;1H