3-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-N-butyl-propanamide

Systemtic Name: 3-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-N-butyl-propanamide Openeye Name: 3-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-N-butyl-propanamide CAS Name: 3-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-N-butylpropanamide IUPAC Name: 3-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-N-butylpropanamide Traditional Name: 3-(1H-benzimidazol-2-yl)-N-butyl-N-piperonyl-propionamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC2=C(C=C1)OCO2)C(=O)CCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCCCN(CC1=CC2=C(C=C1)OCO2)C(=O)CCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H25N3O3/c1-2-3-12-25(14-16-8-9-19-20(13-16)28-15-27-19)22(26)11-10-21-23-17-6-4-5-7-18(17)24-21/h4-9,13H,2-3,10-12,14-15H2,1H3,(H,23,24)