2-(1,3-benzodioxol-5-yl)-N-[[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methyl]ethanamine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methyl]ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]methyl]ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[[2,5-dimethyl-1-(2-propan-2-yl-3-pyrazolyl)-3-pyrrolyl]methyl]ethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methyl]ethanamine Traditional Name: homopiperonyl-[[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]methyl]amine Formula: C22H28N4O2 MolecularWeight: 380.48332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)CNCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)CNCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H28N4O2/c1-15(2)26-22(8-10-24-26)25-16(3)11-19(17(25)4)13-23-9-7-18-5-6-20-21(12-18)28-14-27-20/h5-6,8,10-12,15,23H,7,9,13-14H2,1-4H3