2-[[(E)-6-methoxyhex-5-enoyl]-phenyl-amino]propanoic acid

Systemtic Name: 2-[[(E)-6-methoxyhex-5-enoyl]-phenyl-amino]propanoic acid Openeye Name: 2-(N-[(E)-6-methoxyhex-5-enoyl]anilino)propanoic acid CAS Name: 2-(N-[(E)-6-methoxy-1-oxohex-5-enyl]anilino)propanoic acid IUPAC Name: 2-(N-[(E)-6-methoxyhex-5-enoyl]anilino)propanoic acid Traditional Name: 2-(N-[(E)-6-methoxyhex-5-enoyl]anilino)propionic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=CC=C1)C(=O)CCCC=COC

Isomeric SMILES

CC(C(=O)O)N(C1=CC=CC=C1)C(=O)CCC/C=C/OC

InChI

InChI=1S/C16H21NO4/c1-13(16(19)20)17(14-9-5-3-6-10-14)15(18)11-7-4-8-12-21-2/h3,5-6,8-10,12-13H,4,7,11H2,1-2H3,(H,19,20)/b12-8+