N-[[3-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl]-N-methyl-oxolan-3-amine

Systemtic Name: N-[[3-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl]-N-methyl-oxolan-3-amine Openeye Name: N-[[3-(1,3-benzodioxol-5-yl)-1-benzyl-pyrazol-4-yl]methyl]-N-methyl-tetrahydrofuran-3-amine CAS Name: N-[[3-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-4-pyrazolyl]methyl]-N-methyl-3-oxolanamine IUPAC Name: N-[[3-(1,3-benzodioxol-5-yl)-1-benzylpyrazol-4-yl]methyl]-N-methyloxolan-3-amine Traditional Name: [3-(1,3-benzodioxol-5-yl)-1-benzyl-pyrazol-4-yl]methyl-methyl-tetrahydrofuran-3-yl-amine Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4)C5CCOC5

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4)C5CCOC5

InChI

InChI=1S/C23H25N3O3/c1-25(20-9-10-27-15-20)13-19-14-26(12-17-5-3-2-4-6-17)24-23(19)18-7-8-21-22(11-18)29-16-28-21/h2-8,11,14,20H,9-10,12-13,15-16H2,1H3