3-azanyl-4-[[3-(furan-3-ylmethoxy)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[[3-(furan-3-ylmethoxy)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-(3-furylmethoxymethyl)-2-methoxy-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[3-(3-furanylmethoxy)-1-methoxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[3-(furan-3-ylmethoxy)-1-methoxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[1-(3-furfuryloxymethyl)-2-keto-2-methoxy-ethyl]amino]-4-keto-butyric acid Formula: C13H18N2O7 MolecularWeight: 314.29122

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(COCC1=COC=C1)NC(=O)C(CC(=O)O)N

Isomeric SMILES

COC(=O)C(COCC1=COC=C1)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C13H18N2O7/c1-20-13(19)10(7-22-6-8-2-3-21-5-8)15-12(18)9(14)4-11(16)17/h2-3,5,9-10H,4,6-7,14H2,1H3,(H,15,18)(H,16,17)