(3Z,5Z,9Z,11Z)-1,7-bis(4-bromophenyl)-1,7-diazoniacyclododeca-1,3,5,7,9,11-hexaene dichloride

Systemtic Name: (3Z,5Z,9Z,11Z)-1,7-bis(4-bromophenyl)-1,7-diazoniacyclododeca-1,3,5,7,9,11-hexaene dichloride Openeye Name: (3Z,5Z,9Z,11Z)-1,7-bis(4-bromophenyl)-1,7-diazoniacyclododeca-1,3,5,7,9,11-hexaene dichloride CAS Name: (3Z,5Z,9Z,11Z)-1,7-bis(4-bromophenyl)-1,7-diazoniacyclododeca-1,3,5,7,9,11-hexaene dichloride IUPAC Name: (3Z,5Z,9Z,11Z)-1,7-bis(4-bromophenyl)-1,7-diazoniacyclododeca-1,3,5,7,9,11-hexaene dichloride Traditional Name: (3Z,5Z,9Z,11Z)-1,7-bis(4-bromophenyl)-1,7-diazoniacyclododeca-1,3,5,7,9,11-hexaene dichloride Formula: C22H18Br2Cl2N2 MolecularWeight: 541.10572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=CC=CC=[N+](C=C1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br.[Cl-].[Cl-]

Isomeric SMILES

C\1=C\C=[N+](/C=C\C=C/C=[N+](\C=C1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br.[Cl-].[Cl-]

InChI

InChI=1S/C22H18Br2N2.2ClH/c23-19-7-11-21(12-8-19)25-15-3-1-4-16-26(18-6-2-5-17-25)22-13-9-20(24)10-14-22;;/h1-18H;2*1H/q+2;;/p-2/b3-1-,4-1?,5-2?,6-2-,15-3?,16-4-,17-5-,18-6?,25-15?,25-17?,26-16?,26-18?;;