2-[(4-carbamimidoylphenoxy)methyl]-1-methyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[(4-carbamimidoylphenoxy)methyl]-1-methyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[(4-carbamimidoylphenoxy)methyl]-1-methyl-benzimidazole-5-carboxylic acid CAS Name: 2-[(4-carbamimidoylphenoxy)methyl]-1-methyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[(4-carbamimidoylphenoxy)methyl]-1-methylbenzimidazole-5-carboxylic acid Traditional Name: 2-[(4-amidinophenoxy)methyl]-1-methyl-benzimidazole-5-carboxylic acid Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)O)N=C1COC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)O)N=C1COC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C17H16N4O3/c1-21-14-7-4-11(17(22)23)8-13(14)20-15(21)9-24-12-5-2-10(3-6-12)16(18)19/h2-8H,9H2,1H3,(H3,18,19)(H,22,23)