2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[[(E)-3-(5-methyl-2-furyl)prop-2-enoyl]amino]butanoic acid CAS Name: 3-hydroxy-2-[[(E)-3-(5-methyl-2-furanyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 3-hydroxy-2-[[(E)-3-(5-methyl-2-furyl)acryloyl]amino]butyric acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5/c1-7-3-4-9(18-7)5-6-10(15)13-11(8(2)14)12(16)17/h3-6,8,11,14H,1-2H3,(H,13,15)(H,16,17)/b6-5+