3-[(2-methyl-1-phenethyl-3-phenylmethoxy-pyridin-1-ium-4-yl)amino]propan-1-ol

Systemtic Name: 3-[(2-methyl-1-phenethyl-3-phenylmethoxy-pyridin-1-ium-4-yl)amino]propan-1-ol Openeye Name: 3-[(3-benzyloxy-2-methyl-1-phenethyl-pyridin-1-ium-4-yl)amino]propan-1-ol CAS Name: 3-[(2-methyl-1-phenethyl-3-phenylmethoxy-4-pyridin-1-iumyl)amino]-1-propanol IUPAC Name: 3-[(2-methyl-1-phenethyl-3-phenylmethoxypyridin-1-ium-4-yl)amino]propan-1-ol Traditional Name: 3-[(3-benzoxy-2-methyl-1-phenethyl-pyridin-1-ium-4-yl)amino]propan-1-ol Formula: C24H29N2O2+ MolecularWeight: 377.49926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CC(=C1OCC2=CC=CC=C2)NCCCO)CCC3=CC=CC=C3

Isomeric SMILES

CC1=[N+](C=CC(=C1OCC2=CC=CC=C2)NCCCO)CCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O2/c1-20-24(28-19-22-11-6-3-7-12-22)23(25-15-8-18-27)14-17-26(20)16-13-21-9-4-2-5-10-21/h2-7,9-12,14,17,27H,8,13,15-16,18-19H2,1H3/p+1