4-[2-(hexanoylamino)ethyl]benzoic acid

Systemtic Name: 4-[2-(hexanoylamino)ethyl]benzoic acid Openeye Name: 4-[2-(hexanoylamino)ethyl]benzoic acid CAS Name: 4-[2-(1-oxohexylamino)ethyl]benzoic acid IUPAC Name: 4-[2-(hexanoylamino)ethyl]benzoic acid Traditional Name: 4-[2-(caproylamino)ethyl]benzoic acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NCCC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCCC(=O)NCCC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C15H21NO3/c1-2-3-4-5-14(17)16-11-10-12-6-8-13(9-7-12)15(18)19/h6-9H,2-5,10-11H2,1H3,(H,16,17)(H,18,19)