2-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyl-(pyridin-3-ylmethyl)amino]ethanol

Systemtic Name: 2-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyl-(pyridin-3-ylmethyl)amino]ethanol Openeye Name: 2-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyl-(3-pyridylmethyl)amino]ethanol CAS Name: 2-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]methyl-(3-pyridinylmethyl)amino]ethanol IUPAC Name: 2-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]methyl-(pyridin-3-ylmethyl)amino]ethanol Traditional Name: 2-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyl-(3-pyridylmethyl)amino]ethanol Formula: C22H25N3O3 MolecularWeight: 379.4522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)CN(CCO)CC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)CN(CCO)CC4=CN=CC=C4

InChI

InChI=1S/C22H25N3O3/c1-16-10-19(14-24(8-9-26)13-18-4-3-7-23-12-18)17(2)25(16)20-5-6-21-22(11-20)28-15-27-21/h3-7,10-12,26H,8-9,13-15H2,1-2H3