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

Systemtic Name: 2-[[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]methyl-(pyridin-3-ylmethyl)amino]ethanol Openeye Name: 2-[(1-benzyl-2,5-dimethyl-pyrrol-3-yl)methyl-(3-pyridylmethyl)amino]ethanol CAS Name: 2-[[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]methyl-(3-pyridinylmethyl)amino]ethanol IUPAC Name: 2-[(1-benzyl-2,5-dimethylpyrrol-3-yl)methyl-(pyridin-3-ylmethyl)amino]ethanol Traditional Name: 2-[(1-benzyl-2,5-dimethyl-pyrrol-3-yl)methyl-(3-pyridylmethyl)amino]ethanol Formula: C22H27N3O MolecularWeight: 349.46928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)CN(CCO)CC3=CN=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)CN(CCO)CC3=CN=CC=C3

InChI

InChI=1S/C22H27N3O/c1-18-13-22(19(2)25(18)16-20-7-4-3-5-8-20)17-24(11-12-26)15-21-9-6-10-23-14-21/h3-10,13-14,26H,11-12,15-17H2,1-2H3