5-[5-carbamimidoyl-2-[3-oxidanyl-2,3-bis(oxidanylidene)propyl]phenoxy]-4-(2,3-dihydro-1-benzofuran-6-ylcarbonylamino)pentanoic acid

Systemtic Name: 5-[5-carbamimidoyl-2-[3-oxidanyl-2,3-bis(oxidanylidene)propyl]phenoxy]-4-(2,3-dihydro-1-benzofuran-6-ylcarbonylamino)pentanoic acid Openeye Name: 5-[5-carbamimidoyl-2-(3-hydroxy-2,3-dioxo-propyl)phenoxy]-4-(2,3-dihydrobenzofuran-6-carbonylamino)pentanoic acid CAS Name: 5-[5-carbamimidoyl-2-(3-hydroxy-2,3-dioxopropyl)phenoxy]-4-[[2,3-dihydrobenzofuran-6-yl(oxo)methyl]amino]pentanoic acid IUPAC Name: 5-[5-carbamimidoyl-2-(3-hydroxy-2,3-dioxopropyl)phenoxy]-4-(2,3-dihydro-1-benzofuran-6-carbonylamino)pentanoic acid Traditional Name: 5-[5-amidino-2-(3-hydroxy-2,3-diketo-propyl)phenoxy]-4-(coumaran-6-carbonylamino)valeric acid Formula: C24H25N3O8 MolecularWeight: 483.4706

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=CC(=C2)C(=O)NC(CCC(=O)O)COC3=C(C=CC(=C3)C(=N)N)CC(=O)C(=O)O

Isomeric SMILES

C1COC2=C1C=CC(=C2)C(=O)NC(CCC(=O)O)COC3=C(C=CC(=C3)C(=N)N)CC(=O)C(=O)O

InChI

InChI=1S/C24H25N3O8/c25-22(26)15-3-2-14(9-18(28)24(32)33)20(10-15)35-12-17(5-6-21(29)30)27-23(31)16-4-1-13-7-8-34-19(13)11-16/h1-4,10-11,17H,5-9,12H2,(H3,25,26)(H,27,31)(H,29,30)(H,32,33)