3-[2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)benzimidazol-5-yl]propanamide

Systemtic Name: 3-[2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)benzimidazol-5-yl]propanamide Openeye Name: 3-[2-amino-1-(1,3-benzodioxol-5-ylmethyl)benzimidazol-5-yl]propanamide CAS Name: 3-[2-amino-1-(1,3-benzodioxol-5-ylmethyl)-5-benzimidazolyl]propanamide IUPAC Name: 3-[2-amino-1-(1,3-benzodioxol-5-ylmethyl)benzimidazol-5-yl]propanamide Traditional Name: 3-(2-amino-1-piperonyl-benzimidazol-5-yl)propionamide Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C4=C(C=C(C=C4)CCC(=O)N)N=C3N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C4=C(C=C(C=C4)CCC(=O)N)N=C3N

InChI

InChI=1S/C18H18N4O3/c19-17(23)6-3-11-1-4-14-13(7-11)21-18(20)22(14)9-12-2-5-15-16(8-12)25-10-24-15/h1-2,4-5,7-8H,3,6,9-10H2,(H2,19,23)(H2,20,21)