2-[[3,5-bis(dodecoxycarbonyl)phenyl]-(carboxymethyl)amino]ethanoic acid

Systemtic Name: 2-[[3,5-bis(dodecoxycarbonyl)phenyl]-(carboxymethyl)amino]ethanoic acid Openeye Name: 2-[N-(carboxymethyl)-3,5-bis(dodecoxycarbonyl)anilino]acetic acid CAS Name: 2-[N-(carboxymethyl)-3,5-bis[dodecoxy(oxo)methyl]anilino]acetic acid IUPAC Name: 2-[N-(carboxymethyl)-3,5-bis(dodecoxycarbonyl)anilino]acetic acid Traditional Name: 2-[N-(carboxymethyl)-3,5-bis(lauryloxycarbonyl)anilino]acetic acid Formula: C36H59NO8 MolecularWeight: 633.85556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)N(CC(=O)O)CC(=O)O)C(=O)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1)N(CC(=O)O)CC(=O)O)C(=O)OCCCCCCCCCCCC

InChI

InChI=1S/C36H59NO8/c1-3-5-7-9-11-13-15-17-19-21-23-44-35(42)30-25-31(27-32(26-30)37(28-33(38)39)29-34(40)41)36(43)45-24-22-20-18-16-14-12-10-8-6-4-2/h25-27H,3-24,28-29H2,1-2H3,(H,38,39)(H,40,41)