2-[(4-acetamidophenyl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[(4-acetamidophenyl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)-3H-benzimidazole-5-carboxamide Openeye Name: 2-[(4-acetamidophenyl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[(4-acetamidophenyl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[(4-acetamidophenyl)methyl]-N-(1,3-benzodioxol-5-ylmethyl)-3H-benzimidazole-5-carboxamide Traditional Name: 2-(4-acetamidobenzyl)-N-piperonyl-3H-benzimidazole-5-carboxamide Formula: C25H22N4O4 MolecularWeight: 442.46658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CC2=NC3=C(N2)C=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CC2=NC3=C(N2)C=C(C=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H22N4O4/c1-15(30)27-19-6-2-16(3-7-19)11-24-28-20-8-5-18(12-21(20)29-24)25(31)26-13-17-4-9-22-23(10-17)33-14-32-22/h2-10,12H,11,13-14H2,1H3,(H,26,31)(H,27,30)(H,28,29)