[4-[(4-dimethylaminophenyl)-[4-(methylamino)phenyl]methyl]cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium; methane

Systemtic Name: [4-[(4-dimethylaminophenyl)-[4-(methylamino)phenyl]methyl]cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium; methane Openeye Name: [4-[(4-dimethylaminophenyl)-[4-(methylamino)phenyl]methyl]cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium; methane CAS Name: [4-[(4-dimethylaminophenyl)-[4-(methylamino)phenyl]methyl]-1-cyclohexa-2,5-dienylidene]-dimethylammonium; methane IUPAC Name: [4-[(4-dimethylaminophenyl)-[4-(methylamino)phenyl]methyl]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium; methane Traditional Name: [4-[(4-dimethylaminophenyl)-[4-(methylamino)phenyl]methyl]cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium; methane Formula: C74H98N9+3 MolecularWeight: 1113.63022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C.C.CNC1=CC=C(C=C1)C(C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.CNC1=CC=C(C=C1)C(C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.CNC1=CC=C(C=C1)C(C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

C.C.CNC1=CC=C(C=C1)C(C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.CNC1=CC=C(C=C1)C(C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.CNC1=CC=C(C=C1)C(C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/3C24H30N3.2CH4/c3*1-25-21-12-6-18(7-13-21)24(19-8-14-22(15-9-19)26(2)3)20-10-16-23(17-11-20)27(4)5;;/h3*6-17,19,24-25H,1-5H3;2*1H4/q3*+1;;