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

Systemtic Name: (2S)-2-[[(E)-3-(furan-2-yl)-2-(furan-2-ylcarbonylamino)prop-2-enoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[(E)-2-(furan-2-carbonylamino)-3-(2-furyl)prop-2-enoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(E)-3-(2-furanyl)-2-[[2-furanyl(oxo)methyl]amino]-1-oxoprop-2-enyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[(E)-2-(furan-2-carbonylamino)-3-(furan-2-yl)prop-2-enoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[(E)-2-(2-furoylamino)-3-(2-furyl)acryloyl]amino]-3-methyl-butyric acid Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(=CC1=CC=CO1)NC(=O)C2=CC=CO2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)/C(=C\C1=CC=CO1)/NC(=O)C2=CC=CO2

InChI

InChI=1S/C17H18N2O6/c1-10(2)14(17(22)23)19-15(20)12(9-11-5-3-7-24-11)18-16(21)13-6-4-8-25-13/h3-10,14H,1-2H3,(H,18,21)(H,19,20)(H,22,23)/b12-9+/t14-/m0/s1