4-[[2-(4-butan-2-ylphenoxy)ethanoylamino]methyl]benzoic acid

Systemtic Name: 4-[[2-(4-butan-2-ylphenoxy)ethanoylamino]methyl]benzoic acid Openeye Name: 4-[[[2-(4-sec-butylphenoxy)acetyl]amino]methyl]benzoic acid CAS Name: 4-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]methyl]benzoic acid Traditional Name: 4-[[[2-(4-sec-butylphenoxy)acetyl]amino]methyl]benzoic acid Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C20H23NO4/c1-3-14(2)16-8-10-18(11-9-16)25-13-19(22)21-12-15-4-6-17(7-5-15)20(23)24/h4-11,14H,3,12-13H2,1-2H3,(H,21,22)(H,23,24)