4-[[2,5-dimethyl-4-[(4-oxidanyl-4-oxidanylidene-butyl)carbamoyl]furan-3-yl]carbonylamino]butanoic acid

Systemtic Name: 4-[[2,5-dimethyl-4-[(4-oxidanyl-4-oxidanylidene-butyl)carbamoyl]furan-3-yl]carbonylamino]butanoic acid Openeye Name: 4-[[4-[(4-hydroxy-4-oxo-butyl)carbamoyl]-2,5-dimethyl-furan-3-carbonyl]amino]butanoic acid CAS Name: 4-[[[4-[[(4-hydroxy-4-oxobutyl)amino]-oxomethyl]-2,5-dimethyl-3-furanyl]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[4-[(4-hydroxy-4-oxobutyl)carbamoyl]-2,5-dimethylfuran-3-carbonyl]amino]butanoic acid Traditional Name: 4-[[4-[(4-hydroxy-4-keto-butyl)carbamoyl]-2,5-dimethyl-3-furoyl]amino]butyric acid Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)C)C(=O)NCCCC(=O)O)C(=O)NCCCC(=O)O

Isomeric SMILES

CC1=C(C(=C(O1)C)C(=O)NCCCC(=O)O)C(=O)NCCCC(=O)O

InChI

InChI=1S/C16H22N2O7/c1-9-13(15(23)17-7-3-5-11(19)20)14(10(2)25-9)16(24)18-8-4-6-12(21)22/h3-8H2,1-2H3,(H,17,23)(H,18,24)(H,19,20)(H,21,22)