(2S)-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[(E)-3-(2-furyl)prop-2-enoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[(E)-3-(2-furyl)acryloyl]amino]-3-methyl-butyric acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C=CC1=CC=CO1

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)/C=C/C1=CC=CO1

InChI

InChI=1S/C12H15NO4/c1-8(2)11(12(15)16)13-10(14)6-5-9-4-3-7-17-9/h3-8,11H,1-2H3,(H,13,14)(H,15,16)/b6-5+/t11-/m0/s1