2,3,6-triphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate

Systemtic Name: 2,3,6-triphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate Openeye Name: 2,3,6-triphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate CAS Name: 2,3,6-triphenyl-4-(4,6,8-trimethyl-1-azulenyl)pyrylium perchlorate IUPAC Name: 2,3,6-triphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate Traditional Name: 2,3,6-triphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate Formula: C36H29ClO5 MolecularWeight: 577.06546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC(=C2C(=C1)C)C3=CC(=[O+]C(=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=C2C=CC(=C2C(=C1)C)C3=CC(=[O+]C(=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C36H29O.ClHO4/c1-24-21-25(2)30-19-20-31(34(30)26(3)22-24)32-23-33(27-13-7-4-8-14-27)37-36(29-17-11-6-12-18-29)35(32)28-15-9-5-10-16-28;2-1(3,4)5/h4-23H,1-3H3;(H,2,3,4,5)/q+1;/p-1