(2-dodecoxy-2-oxidanylidene-ethyl) 2-azanyl-3-[3,4-bis(oxidanyl)phenyl]-2-methyl-propanoate

Systemtic Name: (2-dodecoxy-2-oxidanylidene-ethyl) 2-azanyl-3-[3,4-bis(oxidanyl)phenyl]-2-methyl-propanoate Openeye Name: (2-dodecoxy-2-oxo-ethyl) 2-amino-3-(3,4-dihydroxyphenyl)-2-methyl-propanoate CAS Name: 2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid (2-dodecoxy-2-oxoethyl) ester IUPAC Name: (2-dodecoxy-2-oxoethyl) 2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoate Traditional Name: 2-amino-3-(3,4-dihydroxyphenyl)-2-methyl-propionic acid (2-keto-2-lauryloxy-ethyl) ester Formula: C24H39NO6 MolecularWeight: 437.56956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)COC(=O)C(C)(CC1=CC(=C(C=C1)O)O)N

Isomeric SMILES

CCCCCCCCCCCCOC(=O)COC(=O)C(C)(CC1=CC(=C(C=C1)O)O)N

InChI

InChI=1S/C24H39NO6/c1-3-4-5-6-7-8-9-10-11-12-15-30-22(28)18-31-23(29)24(2,25)17-19-13-14-20(26)21(27)16-19/h13-14,16,26-27H,3-12,15,17-18,25H2,1-2H3