4-oxidanylidene-4-[1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-yl]oxy-butanoic acid hydrochloride

Systemtic Name: 4-oxidanylidene-4-[1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-yl]oxy-butanoic acid hydrochloride Openeye Name: 4-[1-[(2-allylphenoxy)methyl]-2-(isopropylamino)ethoxy]-4-oxo-butanoic acid hydrochloride CAS Name: 4-oxo-4-[1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-yl]oxybutanoic acid hydrochloride IUPAC Name: 4-oxo-4-[1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-yl]oxybutanoic acid hydrochloride Traditional Name: 4-[1-[(2-allylphenoxy)methyl]-2-(isopropylamino)ethoxy]-4-keto-butyric acid hydrochloride Formula: C19H28ClNO5 MolecularWeight: 385.88232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC=C1CC=C)OC(=O)CCC(=O)O.Cl

Isomeric SMILES

CC(C)NCC(COC1=CC=CC=C1CC=C)OC(=O)CCC(=O)O.Cl

InChI

InChI=1S/C19H27NO5.ClH/c1-4-7-15-8-5-6-9-17(15)24-13-16(12-20-14(2)3)25-19(23)11-10-18(21)22;/h4-6,8-9,14,16,20H,1,7,10-13H2,2-3H3,(H,21,22);1H