2-[4-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]phenyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[4-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]phenyl]-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-[(6-chloro-1,3-benzodioxol-5-yl)methyl]phenyl]-3H-benzimidazole-5-carboxamide Formula: C22H16ClN3O3 MolecularWeight: 405.83374

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CC3=CC=C(C=C3)C4=NC5=C(N4)C=C(C=C5)C(=O)N)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CC3=CC=C(C=C3)C4=NC5=C(N4)C=C(C=C5)C(=O)N)Cl

InChI

InChI=1S/C22H16ClN3O3/c23-16-10-20-19(28-11-29-20)9-15(16)7-12-1-3-13(4-2-12)22-25-17-6-5-14(21(24)27)8-18(17)26-22/h1-6,8-10H,7,11H2,(H2,24,27)(H,25,26)