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

Systemtic Name: 2-[4-(pentanoylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(pentanoylamino)phenyl]acetic acid CAS Name: 2-[4-(1-oxopentylamino)phenyl]acetic acid IUPAC Name: 2-[4-(pentanoylamino)phenyl]acetic acid Traditional Name: 2-[4-(valerylamino)phenyl]acetic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-2-3-4-12(15)14-11-7-5-10(6-8-11)9-13(16)17/h5-8H,2-4,9H2,1H3,(H,14,15)(H,16,17)