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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]methanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]methanamine Traditional Name: piperonyl-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]amine Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)CNCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)CNCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19N3O2/c1-13-2-5-15(6-3-13)19-16(11-21-22-19)10-20-9-14-4-7-17-18(8-14)24-12-23-17/h2-8,11,20H,9-10,12H2,1H3,(H,21,22)