3-[4-(2-propylpentanoylamino)phenyl]propanoic acid

Systemtic Name: 3-[4-(2-propylpentanoylamino)phenyl]propanoic acid Openeye Name: 3-[4-(2-propylpentanoylamino)phenyl]propanoic acid CAS Name: 3-[4-[(1-oxo-2-propylpentyl)amino]phenyl]propanoic acid IUPAC Name: 3-[4-(2-propylpentanoylamino)phenyl]propanoic acid Traditional Name: 3-[4-(2-propylpentanoylamino)phenyl]propionic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC=C(C=C1)CCC(=O)O

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC=C(C=C1)CCC(=O)O

InChI

InChI=1S/C17H25NO3/c1-3-5-14(6-4-2)17(21)18-15-10-7-13(8-11-15)9-12-16(19)20/h7-8,10-11,14H,3-6,9,12H2,1-2H3,(H,18,21)(H,19,20)