5-[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-(4-carbamimidoylphenyl)-1-methyl-benzimidazol-5-yl]-5-oxo-pentanoic acid CAS Name: 5-[2-(4-carbamimidoylphenyl)-1-methyl-5-benzimidazolyl]-5-oxopentanoic acid IUPAC Name: 5-[2-(4-carbamimidoylphenyl)-1-methylbenzimidazol-5-yl]-5-oxopentanoic acid Traditional Name: 5-[2-(4-amidinophenyl)-1-methyl-benzimidazol-5-yl]-5-keto-valeric acid Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)CCCC(=O)O)N=C1C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)CCCC(=O)O)N=C1C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H20N4O3/c1-24-16-10-9-14(17(25)3-2-4-18(26)27)11-15(16)23-20(24)13-7-5-12(6-8-13)19(21)22/h5-11H,2-4H2,1H3,(H3,21,22)(H,26,27)