1-(1,3-benzodioxol-5-yl)-N-[(1-tert-butylpyrazol-4-yl)methyl]methanamine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(1-tert-butylpyrazol-4-yl)methyl]methanamine Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[(1-tert-butylpyrazol-4-yl)methyl]methanamine CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[(1-tert-butyl-4-pyrazolyl)methyl]methanamine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(1-tert-butylpyrazol-4-yl)methyl]methanamine Traditional Name: (1-tert-butylpyrazol-4-yl)methyl-piperonyl-amine Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C=N1)CNCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)N1C=C(C=N1)CNCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H21N3O2/c1-16(2,3)19-10-13(9-18-19)8-17-7-12-4-5-14-15(6-12)21-11-20-14/h4-6,9-10,17H,7-8,11H2,1-3H3