methyl 4-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-4-methyl-phenyl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[2-[3-(tert-butylamino)-2-oxidanyl-propoxy]-4-methyl-phenyl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]-4-methyl-phenyl]-4-oxo-butanoate CAS Name: 4-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-4-methylphenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-[3-(tert-butylamino)-2-hydroxypropoxy]-4-methylphenyl]-4-oxobutanoate Traditional Name: 4-[2-[3-(tert-butylamino)-2-hydroxy-propoxy]-4-methyl-phenyl]-4-keto-butyric acid methyl ester Formula: C19H29NO5 MolecularWeight: 351.43726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)CCC(=O)OC)OCC(CNC(C)(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)CCC(=O)OC)OCC(CNC(C)(C)C)O

InChI

InChI=1S/C19H29NO5/c1-13-6-7-15(16(22)8-9-18(23)24-5)17(10-13)25-12-14(21)11-20-19(2,3)4/h6-7,10,14,20-21H,8-9,11-12H2,1-5H3