N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloranyl-1H-benzimidazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloranyl-1H-benzimidazol-2-yl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloro-1H-benzimidazol-2-yl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloro-1H-benzimidazol-2-yl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(6-chloro-1H-benzimidazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(6-chloro-1H-benzimidazol-2-yl)-N-piperonyl-isonipecotamide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC5=C(N4)C=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC5=C(N4)C=C(C=C5)Cl

InChI

InChI=1S/C21H21ClN4O3/c22-15-2-3-16-17(10-15)25-21(24-16)26-7-5-14(6-8-26)20(27)23-11-13-1-4-18-19(9-13)29-12-28-18/h1-4,9-10,14H,5-8,11-12H2,(H,23,27)(H,24,25)