4-dodecyl-2-(4-methylphenyl)chromenylium perchlorate

Systemtic Name: 4-dodecyl-2-(4-methylphenyl)chromenylium perchlorate Openeye Name: 4-dodecyl-2-(p-tolyl)chromenylium perchlorate CAS Name: 4-dodecyl-2-(4-methylphenyl)-1-benzopyrylium perchlorate IUPAC Name: 4-dodecyl-2-(4-methylphenyl)chromenylium perchlorate Traditional Name: 4-lauryl-2-(p-tolyl)-1-benzopyrylium perchlorate Formula: C28H37ClO5 MolecularWeight: 489.04338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=[O+]C2=CC=CC=C21)C3=CC=C(C=C3)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=[O+]C2=CC=CC=C21)C3=CC=C(C=C3)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H37O.ClHO4/c1-3-4-5-6-7-8-9-10-11-12-15-25-22-28(24-20-18-23(2)19-21-24)29-27-17-14-13-16-26(25)27;2-1(3,4)5/h13-14,16-22H,3-12,15H2,1-2H3;(H,2,3,4,5)/q+1;/p-1