4-oxidanylidene-4-[[3-oxidanylidene-2-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)-3-phenylazanyl-propyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[3-oxidanylidene-2-(2-oxidanyl-5-oxidanylidene-2H-furan-3-yl)-3-phenylazanyl-propyl]amino]butanoic acid Openeye Name: 4-[[3-anilino-2-(2-hydroxy-5-oxo-2H-furan-3-yl)-3-oxo-propyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-anilino-2-(2-hydroxy-5-oxo-2H-furan-3-yl)-3-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-anilino-2-(2-hydroxy-5-oxo-2H-furan-3-yl)-3-oxopropyl]amino]-4-oxobutanoic acid Traditional Name: 4-[[3-anilino-2-(2-hydroxy-5-keto-2H-furan-3-yl)-3-keto-propyl]amino]-4-keto-butyric acid Formula: C17H18N2O7 MolecularWeight: 362.33402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(CNC(=O)CCC(=O)O)C2=CC(=O)OC2O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C(CNC(=O)CCC(=O)O)C2=CC(=O)OC2O

InChI

InChI=1S/C17H18N2O7/c20-13(6-7-14(21)22)18-9-12(11-8-15(23)26-17(11)25)16(24)19-10-4-2-1-3-5-10/h1-5,8,12,17,25H,6-7,9H2,(H,18,20)(H,19,24)(H,21,22)