3-methyl-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]pentanoic acid

Systemtic Name: 3-methyl-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]pentanoic acid Openeye Name: 3-methyl-2-[[(E)-3-(5-methyl-2-furyl)prop-2-enoyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[(E)-3-(5-methyl-2-furanyl)-1-oxoprop-2-enyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]pentanoic acid Traditional Name: 3-methyl-2-[[(E)-3-(5-methyl-2-furyl)acryloyl]amino]valeric acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C=CC1=CC=C(O1)C

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)/C=C/C1=CC=C(O1)C

InChI

InChI=1S/C14H19NO4/c1-4-9(2)13(14(17)18)15-12(16)8-7-11-6-5-10(3)19-11/h5-9,13H,4H2,1-3H3,(H,15,16)(H,17,18)/b8-7+