[4-[bis(6-bromanylazulen-1-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium

Systemtic Name: [4-[bis(6-bromanylazulen-1-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium Openeye Name: [4-[bis(6-bromoazulen-1-yl)methylene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium CAS Name: [4-[bis(6-bromo-1-azulenyl)methylidene]-1-cyclohexa-2,5-dienylidene]-dimethylammonium IUPAC Name: [4-[bis(6-bromoazulen-1-yl)methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium Traditional Name: [4-[bis(6-bromoazulen-1-yl)methylene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium Formula: C29H22Br2N+ MolecularWeight: 544.29968

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1C=CC(=C(C2=C3C=CC(=CC=C3C=C2)Br)C4=C5C=CC(=CC=C5C=C4)Br)C=C1)C

Isomeric SMILES

C[N+](=C1C=CC(=C(C2=C3C=CC(=CC=C3C=C2)Br)C4=C5C=CC(=CC=C5C=C4)Br)C=C1)C

InChI

InChI=1S/C29H22Br2N/c1-32(2)24-13-5-21(6-14-24)29(27-15-7-19-3-9-22(30)11-17-25(19)27)28-16-8-20-4-10-23(31)12-18-26(20)28/h3-18H,1-2H3/q+1