2-[4-(2-ethylhexanoylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-ethylhexanoylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(2-ethylhexanoylamino)phenyl]acetic acid CAS Name: 2-[4-[(2-ethyl-1-oxohexyl)amino]phenyl]acetic acid IUPAC Name: 2-[4-(2-ethylhexanoylamino)phenyl]acetic acid Traditional Name: 2-[4-(2-ethylhexanoylamino)phenyl]acetic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C16H23NO3/c1-3-5-6-13(4-2)16(20)17-14-9-7-12(8-10-14)11-15(18)19/h7-10,13H,3-6,11H2,1-2H3,(H,17,20)(H,18,19)