4-[[2-(4-carbamimidoylphenyl)-3-oxidanylidene-1H-isoindol-5-yl]oxy]butanoic acid

Systemtic Name: 4-[[2-(4-carbamimidoylphenyl)-3-oxidanylidene-1H-isoindol-5-yl]oxy]butanoic acid Openeye Name: 4-[2-(4-carbamimidoylphenyl)-3-oxo-isoindolin-5-yl]oxybutanoic acid CAS Name: 4-[[2-(4-carbamimidoylphenyl)-3-oxo-1H-isoindol-5-yl]oxy]butanoic acid IUPAC Name: 4-[[2-(4-carbamimidoylphenyl)-3-oxo-1H-isoindol-5-yl]oxy]butanoic acid Traditional Name: 4-[2-(4-amidinophenyl)-3-keto-isoindolin-5-yl]oxybutyric acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)OCCCC(=O)O)C(=O)N1C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1C2=C(C=C(C=C2)OCCCC(=O)O)C(=O)N1C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H19N3O4/c20-18(21)12-3-6-14(7-4-12)22-11-13-5-8-15(10-16(13)19(22)25)26-9-1-2-17(23)24/h3-8,10H,1-2,9,11H2,(H3,20,21)(H,23,24)