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

Systemtic Name: 3-methyl-2,6-diphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate Openeye Name: 3-methyl-2,6-diphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate CAS Name: 3-methyl-2,6-diphenyl-4-(4,6,8-trimethyl-1-azulenyl)pyrylium perchlorate IUPAC Name: 3-methyl-2,6-diphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate Traditional Name: 3-methyl-2,6-diphenyl-4-(4,6,8-trimethylazulen-1-yl)pyrylium perchlorate Formula: C31H27ClO5 MolecularWeight: 514.99608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC(=C2C(=C1)C)C3=CC(=[O+]C(=C3C)C4=CC=CC=C4)C5=CC=CC=C5)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=C2C=CC(=C2C(=C1)C)C3=CC(=[O+]C(=C3C)C4=CC=CC=C4)C5=CC=CC=C5)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C31H27O.ClHO4/c1-20-17-21(2)26-15-16-27(30(26)22(3)18-20)28-19-29(24-11-7-5-8-12-24)32-31(23(28)4)25-13-9-6-10-14-25;2-1(3,4)5/h5-19H,1-4H3;(H,2,3,4,5)/q+1;/p-1