2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]pentanedioic acid

Systemtic Name: 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]pentanedioic acid Openeye Name: 2-[[(E)-3-(2-furyl)prop-2-enoyl]amino]pentanedioic acid CAS Name: 2-[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]pentanedioic acid IUPAC Name: 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]pentanedioic acid Traditional Name: 2-[[(E)-3-(2-furyl)acryloyl]amino]glutaric acid Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=CC(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=COC(=C1)/C=C/C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C12H13NO6/c14-10(5-3-8-2-1-7-19-8)13-9(12(17)18)4-6-11(15)16/h1-3,5,7,9H,4,6H2,(H,13,14)(H,15,16)(H,17,18)/b5-3+