N-(1,3-benzodioxol-5-ylmethyl)-N-[(3,5-dimethyl-1-propan-2-yl-pyrazol-4-yl)methyl]-1-(oxolan-2-yl)methanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3,5-dimethyl-1-propan-2-yl-pyrazol-4-yl)methyl]-1-(oxolan-2-yl)methanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-isopropyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1-tetrahydrofuran-2-yl-methanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3,5-dimethyl-1-propan-2-yl-4-pyrazolyl)methyl]-1-(2-oxolanyl)methanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)methyl]-1-(oxolan-2-yl)methanamine Traditional Name: (1-isopropyl-3,5-dimethyl-pyrazol-4-yl)methyl-piperonyl-(tetrahydrofurfuryl)amine Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C)C)CN(CC2CCCO2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=NN1C(C)C)C)CN(CC2CCCO2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H31N3O3/c1-15(2)25-17(4)20(16(3)23-25)13-24(12-19-6-5-9-26-19)11-18-7-8-21-22(10-18)28-14-27-21/h7-8,10,15,19H,5-6,9,11-14H2,1-4H3