2-(hexadecanoyloxymethoxycarbonylamino)-3-(3-hydroxyphenyl)-2-methyl-propanoic acid

Systemtic Name: 2-(hexadecanoyloxymethoxycarbonylamino)-3-(3-hydroxyphenyl)-2-methyl-propanoic acid Openeye Name: 2-(hexadecanoyloxymethoxycarbonylamino)-3-(3-hydroxyphenyl)-2-methyl-propanoic acid CAS Name: 3-(3-hydroxyphenyl)-2-methyl-2-[[oxo(1-oxohexadecoxymethoxy)methyl]amino]propanoic acid IUPAC Name: 2-(hexadecanoyloxymethoxycarbonylamino)-3-(3-hydroxyphenyl)-2-methylpropanoic acid Traditional Name: 2-(hexadecanoyloxymethoxycarbonylamino)-3-(3-hydroxyphenyl)-2-methyl-propionic acid Formula: C28H45NO7 MolecularWeight: 507.6594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCOC(=O)NC(C)(CC1=CC(=CC=C1)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCOC(=O)NC(C)(CC1=CC(=CC=C1)O)C(=O)O

InChI

InChI=1S/C28H45NO7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25(31)35-22-36-27(34)29-28(2,26(32)33)21-23-17-16-18-24(30)20-23/h16-18,20,30H,3-15,19,21-22H2,1-2H3,(H,29,34)(H,32,33)