4-(3-methylazulen-1-yl)-2,6-diphenyl-pyrylium perchlorate

Systemtic Name: 4-(3-methylazulen-1-yl)-2,6-diphenyl-pyrylium perchlorate Openeye Name: 4-(3-methylazulen-1-yl)-2,6-diphenyl-pyrylium perchlorate CAS Name: 4-(3-methyl-1-azulenyl)-2,6-diphenylpyrylium perchlorate IUPAC Name: 4-(3-methylazulen-1-yl)-2,6-diphenylpyrylium perchlorate Traditional Name: 4-(3-methylazulen-1-yl)-2,6-diphenyl-pyrylium perchlorate Formula: C28H21ClO5 MolecularWeight: 472.91634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H21O.ClHO4/c1-20-17-26(25-16-10-4-9-15-24(20)25)23-18-27(21-11-5-2-6-12-21)29-28(19-23)22-13-7-3-8-14-22;2-1(3,4)5/h2-19H,1H3;(H,2,3,4,5)/q+1;/p-1