N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-(1-pyrazolylmethyl)phenyl]benzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Traditional Name: N-homopiperonyl-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Formula: C26H23N3O3 MolecularWeight: 425.47912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC=CC=C3C4=CC=C(C=C4)CN5C=CC=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC=CC=C3C4=CC=C(C=C4)CN5C=CC=N5

InChI

InChI=1S/C26H23N3O3/c30-26(27-14-12-19-8-11-24-25(16-19)32-18-31-24)23-5-2-1-4-22(23)21-9-6-20(7-10-21)17-29-15-3-13-28-29/h1-11,13,15-16H,12,14,17-18H2,(H,27,30)