2-[carboxymethyl-[2,5-di(tetradecoxy)phenyl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[carboxymethyl-[2,5-di(tetradecoxy)phenyl]carbonyl-amino]ethanoic acid Openeye Name: 2-[carboxymethyl-[2,5-di(tetradecoxy)benzoyl]amino]acetic acid CAS Name: 2-[carboxymethyl-[[2,5-di(tetradecoxy)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[carboxymethyl-[2,5-di(tetradecoxy)benzoyl]amino]acetic acid Traditional Name: 2-[carboxymethyl-(2,5-dimyristyloxybenzoyl)amino]acetic acid Formula: C39H67NO7 MolecularWeight: 661.95178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCCCCCCCCCCCCCC)C(=O)N(CC(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCCCCCCCCCCCCCC)C(=O)N(CC(=O)O)CC(=O)O

InChI

InChI=1S/C39H67NO7/c1-3-5-7-9-11-13-15-17-19-21-23-25-29-46-34-27-28-36(35(31-34)39(45)40(32-37(41)42)33-38(43)44)47-30-26-24-22-20-18-16-14-12-10-8-6-4-2/h27-28,31H,3-26,29-30,32-33H2,1-2H3,(H,41,42)(H,43,44)