6-[[(E)-4-phenylbut-2-enoyl]amino]hexanoic acid

Systemtic Name: 6-[[(E)-4-phenylbut-2-enoyl]amino]hexanoic acid Openeye Name: 6-[[(E)-4-phenylbut-2-enoyl]amino]hexanoic acid CAS Name: 6-[[(E)-1-oxo-4-phenylbut-2-enyl]amino]hexanoic acid IUPAC Name: 6-[[(E)-4-phenylbut-2-enoyl]amino]hexanoic acid Traditional Name: 6-[[(E)-4-phenylbut-2-enoyl]amino]hexanoic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC=CC(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C/C=C/C(=O)NCCCCCC(=O)O

InChI

InChI=1S/C16H21NO3/c18-15(17-13-6-2-5-12-16(19)20)11-7-10-14-8-3-1-4-9-14/h1,3-4,7-9,11H,2,5-6,10,12-13H2,(H,17,18)(H,19,20)/b11-7+