2-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)benzimidazol-4-amine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)benzimidazol-4-amine Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-benzyl-benzimidazol-4-amine CAS Name: 2-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-4-benzimidazolamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-benzylbenzimidazol-4-amine Traditional Name: [2-(1,3-benzodioxol-5-yl)-1-benzyl-benzimidazol-4-yl]amine Formula: C21H17N3O2 MolecularWeight: 343.37858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=C(N3CC5=CC=CC=C5)C=CC=C4N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=C(N3CC5=CC=CC=C5)C=CC=C4N

InChI

InChI=1S/C21H17N3O2/c22-16-7-4-8-17-20(16)23-21(24(17)12-14-5-2-1-3-6-14)15-9-10-18-19(11-15)26-13-25-18/h1-11H,12-13,22H2