2-[3-(5-carbamimidoyl-2H-benzimidazol-2-yl)-5-(2,5-dimethoxyphenyl)-4-oxidanyl-phenyl]butanedioic acid

Systemtic Name: 2-[3-(5-carbamimidoyl-2H-benzimidazol-2-yl)-5-(2,5-dimethoxyphenyl)-4-oxidanyl-phenyl]butanedioic acid Openeye Name: 2-[3-(5-carbamimidoyl-2H-benzimidazol-2-yl)-5-(2,5-dimethoxyphenyl)-4-hydroxy-phenyl]butanedioic acid CAS Name: 2-[3-(5-carbamimidoyl-2H-benzimidazol-2-yl)-5-(2,5-dimethoxyphenyl)-4-hydroxyphenyl]butanedioic acid IUPAC Name: 2-[3-(5-carbamimidoyl-2H-benzimidazol-2-yl)-5-(2,5-dimethoxyphenyl)-4-hydroxyphenyl]butanedioic acid Traditional Name: 2-[3-(5-amidino-2H-benzimidazol-2-yl)-5-(2,5-dimethoxyphenyl)-4-hydroxy-phenyl]succinic acid Formula: C26H24N4O7 MolecularWeight: 504.49136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC(=CC(=C2O)C3N=C4C=CC(=CC4=N3)C(=N)N)C(CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC(=CC(=C2O)C3N=C4C=CC(=CC4=N3)C(=N)N)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C26H24N4O7/c1-36-14-4-6-21(37-2)16(10-14)17-7-13(15(26(34)35)11-22(31)32)8-18(23(17)33)25-29-19-5-3-12(24(27)28)9-20(19)30-25/h3-10,15,25,33H,11H2,1-2H3,(H3,27,28)(H,31,32)(H,34,35)