N-(1,3-benzodioxol-5-ylmethyl)-1-(1-butylbenzimidazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1-butylbenzimidazol-2-yl)piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1-butylbenzimidazol-2-yl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1-butyl-2-benzimidazolyl)-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(1-butylbenzimidazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(1-butylbenzimidazol-2-yl)-N-piperonyl-isonipecotamide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H30N4O3/c1-2-3-12-29-21-7-5-4-6-20(21)27-25(29)28-13-10-19(11-14-28)24(30)26-16-18-8-9-22-23(15-18)32-17-31-22/h4-9,15,19H,2-3,10-14,16-17H2,1H3,(H,26,30)