7-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]heptanoic acid

Systemtic Name: 7-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]heptanoic acid Openeye Name: 7-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]heptanoic acid CAS Name: 7-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]heptanoic acid IUPAC Name: 7-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]heptanoic acid Traditional Name: 7-[[(E)-3-(3-pyridyl)acryloyl]amino]enanthic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C=CC(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)/C=C/C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C15H20N2O3/c18-14(9-8-13-6-5-10-16-12-13)17-11-4-2-1-3-7-15(19)20/h5-6,8-10,12H,1-4,7,11H2,(H,17,18)(H,19,20)/b9-8+