7-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]heptanoic acid

Systemtic Name: 7-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]heptanoic acid Openeye Name: 7-[[(E)-3-(5-methyl-2-furyl)prop-2-enoyl]amino]heptanoic acid CAS Name: 7-[[(E)-3-(5-methyl-2-furanyl)-1-oxoprop-2-enyl]amino]heptanoic acid IUPAC Name: 7-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]heptanoic acid Traditional Name: 7-[[(E)-3-(5-methyl-2-furyl)acryloyl]amino]enanthic acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=CC(=O)NCCCCCCC(=O)O

Isomeric SMILES

CC1=CC=C(O1)/C=C/C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C15H21NO4/c1-12-7-8-13(20-12)9-10-14(17)16-11-5-3-2-4-6-15(18)19/h7-10H,2-6,11H2,1H3,(H,16,17)(H,18,19)/b10-9+