N-(1,3-benzodioxol-5-ylmethyl)-1-[3-(1H-pyrazol-4-yl)phenyl]methanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[3-(1H-pyrazol-4-yl)phenyl]methanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[3-(1H-pyrazol-4-yl)phenyl]methanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[3-(1H-pyrazol-4-yl)phenyl]methanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[3-(1H-pyrazol-4-yl)phenyl]methanamine Traditional Name: piperonyl-[3-(1H-pyrazol-4-yl)benzyl]amine Formula: C18H17N3O2 MolecularWeight: 307.34648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=CC(=C3)C4=CNN=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=CC(=C3)C4=CNN=C4

InChI

InChI=1S/C18H17N3O2/c1-2-13(6-15(3-1)16-10-20-21-11-16)8-19-9-14-4-5-17-18(7-14)23-12-22-17/h1-7,10-11,19H,8-9,12H2,(H,20,21)