2-[2-oxidanyl-3-[(phenylmethyl)-propan-2-yl-amino]propoxy]-1-phenyl-ethanone hydrochloride

Systemtic Name: 2-[2-oxidanyl-3-[(phenylmethyl)-propan-2-yl-amino]propoxy]-1-phenyl-ethanone hydrochloride Openeye Name: 2-[3-[benzyl(isopropyl)amino]-2-hydroxy-propoxy]-1-phenyl-ethanone hydrochloride CAS Name: 2-[2-hydroxy-3-[(phenylmethyl)-propan-2-ylamino]propoxy]-1-phenylethanone hydrochloride IUPAC Name: 2-[3-[benzyl(propan-2-yl)amino]-2-hydroxypropoxy]-1-phenylethanone hydrochloride Traditional Name: 2-[3-[benzyl(isopropyl)amino]-2-hydroxy-propoxy]-1-phenyl-ethanone hydrochloride Formula: C21H28ClNO3 MolecularWeight: 377.90492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(COCC(=O)C2=CC=CC=C2)O.Cl

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(COCC(=O)C2=CC=CC=C2)O.Cl

InChI

InChI=1S/C21H27NO3.ClH/c1-17(2)22(13-18-9-5-3-6-10-18)14-20(23)15-25-16-21(24)19-11-7-4-8-12-19;/h3-12,17,20,23H,13-16H2,1-2H3;1H