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1-butyl-4-(4,8-dimethylazulen-1-yl)-2,6-diphenyl-pyridin-1-ium

1-butyl-4-(4,8-dimethylazulen-1-yl)-2,6-diphenyl-pyridin-1-ium

Systemtic Name:1-butyl-4-(4,8-dimethylazulen-1-yl)-2,6-diphenyl-pyridin-1-ium
Openeye Name:1-butyl-4-(4,8-dimethylazulen-1-yl)-2,6-diphenyl-pyridin-1-ium
CAS Name:1-butyl-4-(4,8-dimethyl-1-azulenyl)-2,6-diphenylpyridin-1-ium
IUPAC Name:1-butyl-4-(4,8-dimethylazulen-1-yl)-2,6-diphenylpyridin-1-ium
Traditional Name:1-butyl-4-(4,8-dimethylazulen-1-yl)-2,6-diphenyl-pyridin-1-ium
Formula: C33H32N+
MolecularWeight: 442.61388
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=C4C(=CC=CC(=C4C=C3)C)C)C5=CC=CC=C5


Isomeric SMILES

CCCC[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=C4C(=CC=CC(=C4C=C3)C)C)C5=CC=CC=C5


InChI

InChI=1S/C33H32N/c1-4-5-21-34-31(26-15-8-6-9-16-26)22-28(23-32(34)27-17-10-7-11-18-27)30-20-19-29-24(2)13-12-14-25(3)33(29)30/h6-20,22-23H,4-5,21H2,1-3H3/q+1


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