4-azulen-1-yl-3-bromanyl-2,6-diphenyl-pyrylium

Systemtic Name: 4-azulen-1-yl-3-bromanyl-2,6-diphenyl-pyrylium Openeye Name: 4-azulen-1-yl-3-bromo-2,6-diphenyl-pyrylium CAS Name: 4-(1-azulenyl)-3-bromo-2,6-diphenylpyrylium IUPAC Name: 4-azulen-1-yl-3-bromo-2,6-diphenylpyrylium Traditional Name: 4-azulen-1-yl-3-bromo-2,6-diphenyl-pyrylium Formula: C27H18BrO+ MolecularWeight: 438.33522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[O+]C(=C(C(=C2)C3=C4C=CC=CC=C4C=C3)Br)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=[O+]C(=C(C(=C2)C3=C4C=CC=CC=C4C=C3)Br)C5=CC=CC=C5

InChI

InChI=1S/C27H18BrO/c28-26-24(23-17-16-19-10-4-3-9-15-22(19)23)18-25(20-11-5-1-6-12-20)29-27(26)21-13-7-2-8-14-21/h1-18H/q+1