2-[4-(2-azanylethanoyl)-2-(carboxymethyloxy)phenoxy]-2-butyl-hexanoic acid

Systemtic Name: 2-[4-(2-azanylethanoyl)-2-(carboxymethyloxy)phenoxy]-2-butyl-hexanoic acid Openeye Name: 2-[4-(2-aminoacetyl)-2-(carboxymethyloxy)phenoxy]-2-butyl-hexanoic acid CAS Name: 2-[4-(2-amino-1-oxoethyl)-2-(carboxymethyloxy)phenoxy]-2-butylhexanoic acid IUPAC Name: 2-[4-(2-aminoacetyl)-2-(carboxymethyloxy)phenoxy]-2-butylhexanoic acid Traditional Name: 2-butyl-2-[2-(carboxymethyloxy)-4-glycyl-phenoxy]hexanoic acid Formula: C20H29NO7 MolecularWeight: 395.44676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(C(=O)O)OC1=C(C=C(C=C1)C(=O)CN)OCC(=O)O

Isomeric SMILES

CCCCC(CCCC)(C(=O)O)OC1=C(C=C(C=C1)C(=O)CN)OCC(=O)O

InChI

InChI=1S/C20H29NO7/c1-3-5-9-20(19(25)26,10-6-4-2)28-16-8-7-14(15(22)12-21)11-17(16)27-13-18(23)24/h7-8,11H,3-6,9-10,12-13,21H2,1-2H3,(H,23,24)(H,25,26)