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2-[carboxymethyl-[3,5-di(nonoxy)phenyl]amino]ethanoic acid

2-[carboxymethyl-[3,5-di(nonoxy)phenyl]amino]ethanoic acid

Systemtic Name:2-[carboxymethyl-[3,5-di(nonoxy)phenyl]amino]ethanoic acid
Openeye Name:2-[N-(carboxymethyl)-3,5-di(nonoxy)anilino]acetic acid
CAS Name:2-[N-(carboxymethyl)-3,5-di(nonoxy)anilino]acetic acid
IUPAC Name:2-[N-(carboxymethyl)-3,5-di(nonoxy)anilino]acetic acid
Traditional Name:2-[N-(carboxymethyl)-3,5-di(nonoxy)anilino]acetic acid
Formula: C28H47NO6
MolecularWeight: 493.67588
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC(=CC(=C1)N(CC(=O)O)CC(=O)O)OCCCCCCCCC


Isomeric SMILES

CCCCCCCCCOC1=CC(=CC(=C1)N(CC(=O)O)CC(=O)O)OCCCCCCCCC


InChI

InChI=1S/C28H47NO6/c1-3-5-7-9-11-13-15-17-34-25-19-24(29(22-27(30)31)23-28(32)33)20-26(21-25)35-18-16-14-12-10-8-6-4-2/h19-21H,3-18,22-23H2,1-2H3,(H,30,31)(H,32,33)


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