(E)-2-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)prop-2-enamide Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)prop-2-enamide CAS Name: (E)-2-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3-methoxyphenyl)-N-piperonyl-acrylamide Formula: C25H21N3O4 MolecularWeight: 427.45194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C2=NC3=CC=CC=C3N2)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)/C=C(\C2=NC3=CC=CC=C3N2)/C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H21N3O4/c1-30-18-6-4-5-16(11-18)12-19(24-27-20-7-2-3-8-21(20)28-24)25(29)26-14-17-9-10-22-23(13-17)32-15-31-22/h2-13H,14-15H2,1H3,(H,26,29)(H,27,28)/b19-12+