phenyl 4-[5,6-bis(azanyl)-1H-benzimidazol-2-yl]benzoate dihydrochloride

Systemtic Name: phenyl 4-[5,6-bis(azanyl)-1H-benzimidazol-2-yl]benzoate dihydrochloride Openeye Name: phenyl 4-(5,6-diamino-1H-benzimidazol-2-yl)benzoate dihydrochloride CAS Name: 4-(5,6-diamino-1H-benzimidazol-2-yl)benzoic acid phenyl ester dihydrochloride IUPAC Name: phenyl 4-(5,6-diamino-1H-benzimidazol-2-yl)benzoate dihydrochloride Traditional Name: 4-(5,6-diamino-1H-benzimidazol-2-yl)benzoic acid phenyl ester dihydrochloride Formula: C20H18Cl2N4O2 MolecularWeight: 417.28852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC4=CC(=C(C=C4N3)N)N.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC4=CC(=C(C=C4N3)N)N.Cl.Cl

InChI

InChI=1S/C20H16N4O2.2ClH/c21-15-10-17-18(11-16(15)22)24-19(23-17)12-6-8-13(9-7-12)20(25)26-14-4-2-1-3-5-14;;/h1-11H,21-22H2,(H,23,24);2*1H