1-butyl-4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-diphenyl-pyridin-1-ium

Systemtic Name: 1-butyl-4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-diphenyl-pyridin-1-ium Openeye Name: 1-butyl-4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-diphenyl-pyridin-1-ium CAS Name: 1-butyl-4-(2-tert-butyl-6-methyl-1-azulenyl)-2,6-diphenylpyridin-1-ium IUPAC Name: 1-butyl-4-(2-tert-butyl-6-methylazulen-1-yl)-2,6-diphenylpyridin-1-ium Traditional Name: 1-butyl-4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-diphenyl-pyridin-1-ium Formula: C36H38N+ MolecularWeight: 484.69362

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=C(C=C4C3=CC=C(C=C4)C)C(C)(C)C)C5=CC=CC=C5

Isomeric SMILES

CCCC[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=C(C=C4C3=CC=C(C=C4)C)C(C)(C)C)C5=CC=CC=C5

InChI

InChI=1S/C36H38N/c1-6-7-22-37-33(27-14-10-8-11-15-27)24-30(25-34(37)28-16-12-9-13-17-28)35-31-21-19-26(2)18-20-29(31)23-32(35)36(3,4)5/h8-21,23-25H,6-7,22H2,1-5H3/q+1