2-methyl-1-phenethyl-3-phenylmethoxy-N-propyl-pyridin-1-ium-4-amine

Systemtic Name: 2-methyl-1-phenethyl-3-phenylmethoxy-N-propyl-pyridin-1-ium-4-amine Openeye Name: 3-benzyloxy-2-methyl-1-phenethyl-N-propyl-pyridin-1-ium-4-amine CAS Name: 2-methyl-1-phenethyl-3-phenylmethoxy-N-propyl-4-pyridin-1-iumamine IUPAC Name: 2-methyl-1-phenethyl-3-phenylmethoxy-N-propylpyridin-1-ium-4-amine Traditional Name: (3-benzoxy-2-methyl-1-phenethyl-pyridin-1-ium-4-yl)-propyl-amine Formula: C24H29N2O+ MolecularWeight: 361.49986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=[N+](C=C1)CCC2=CC=CC=C2)C)OCC3=CC=CC=C3

Isomeric SMILES

CCCNC1=C(C(=[N+](C=C1)CCC2=CC=CC=C2)C)OCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O/c1-3-16-25-23-15-18-26(17-14-21-10-6-4-7-11-21)20(2)24(23)27-19-22-12-8-5-9-13-22/h4-13,15,18H,3,14,16-17,19H2,1-2H3/p+1