3,6-dimethyl-1,1-bis[2-(4-nitrophenyl)ethyl]-2H-pyridin-1-ium

Systemtic Name: 3,6-dimethyl-1,1-bis[2-(4-nitrophenyl)ethyl]-2H-pyridin-1-ium Openeye Name: 3,6-dimethyl-1,1-bis[2-(4-nitrophenyl)ethyl]-2H-pyridin-1-ium CAS Name: 3,6-dimethyl-1,1-bis[2-(4-nitrophenyl)ethyl]-2H-pyridin-1-ium IUPAC Name: 3,6-dimethyl-1,1-bis[2-(4-nitrophenyl)ethyl]-2H-pyridin-1-ium Traditional Name: 3,6-dimethyl-1,1-bis[2-(4-nitrophenyl)ethyl]-2H-pyridin-1-ium Formula: C23H26N3O4+ MolecularWeight: 408.47024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C([N+](C1)(CCC2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C([N+](C1)(CCC2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H26N3O4/c1-18-3-4-19(2)26(17-18,15-13-20-5-9-22(10-6-20)24(27)28)16-14-21-7-11-23(12-8-21)25(29)30/h3-12H,13-17H2,1-2H3/q+1