1,2-dimethyl-4,6-bis[4-(3-methylbutoxy)phenyl]pyridin-1-ium

Systemtic Name: 1,2-dimethyl-4,6-bis[4-(3-methylbutoxy)phenyl]pyridin-1-ium Openeye Name: 2,4-bis(4-isopentyloxyphenyl)-1,6-dimethyl-pyridin-1-ium CAS Name: 1,2-dimethyl-4,6-bis[4-(3-methylbutoxy)phenyl]pyridin-1-ium IUPAC Name: 1,2-dimethyl-4,6-bis[4-(3-methylbutoxy)phenyl]pyridin-1-ium Traditional Name: 2,4-bis(4-isoamoxyphenyl)-1,6-dimethyl-pyridin-1-ium Formula: C29H38NO2+ MolecularWeight: 432.61752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1C)C2=CC=C(C=C2)OCCC(C)C)C3=CC=C(C=C3)OCCC(C)C

Isomeric SMILES

CC1=CC(=CC(=[N+]1C)C2=CC=C(C=C2)OCCC(C)C)C3=CC=C(C=C3)OCCC(C)C

InChI

InChI=1S/C29H38NO2/c1-21(2)15-17-31-27-11-7-24(8-12-27)26-19-23(5)30(6)29(20-26)25-9-13-28(14-10-25)32-18-16-22(3)4/h7-14,19-22H,15-18H2,1-6H3/q+1