2-[carboxymethyl-[2-(4-octadecoxyphenyl)-2-oxidanylidene-ethanoyl]amino]ethanoic acid

Systemtic Name: 2-[carboxymethyl-[2-(4-octadecoxyphenyl)-2-oxidanylidene-ethanoyl]amino]ethanoic acid Openeye Name: 2-[carboxymethyl-[2-(4-octadecoxyphenyl)-2-oxo-acetyl]amino]acetic acid CAS Name: 2-[carboxymethyl-[2-(4-octadecoxyphenyl)-1,2-dioxoethyl]amino]acetic acid IUPAC Name: 2-[carboxymethyl-[2-(4-octadecoxyphenyl)-2-oxoacetyl]amino]acetic acid Traditional Name: 2-[carboxymethyl-[2-keto-2-(4-stearyloxyphenyl)acetyl]amino]acetic acid Formula: C30H47NO7 MolecularWeight: 533.69668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)C(=O)N(CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)C(=O)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C30H47NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-38-26-20-18-25(19-21-26)29(36)30(37)31(23-27(32)33)24-28(34)35/h18-21H,2-17,22-24H2,1H3,(H,32,33)(H,34,35)