2-[2-(4-butoxyphenoxy)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(4-butoxyphenoxy)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-butoxyphenoxy)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-butoxyphenoxy)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-butoxyphenoxy)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-butoxyphenoxy)acetyl]amino]-3-methyl-butyric acid Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OCC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OCC(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C17H25NO5/c1-4-5-10-22-13-6-8-14(9-7-13)23-11-15(19)18-16(12(2)3)17(20)21/h6-9,12,16H,4-5,10-11H2,1-3H3,(H,18,19)(H,20,21)