1-dodecyl-3-(4-methylphenyl)benzo[f]chromen-4-ium perchlorate

Systemtic Name: 1-dodecyl-3-(4-methylphenyl)benzo[f]chromen-4-ium perchlorate Openeye Name: 1-dodecyl-3-(p-tolyl)benzo[f]chromen-4-ium perchlorate CAS Name: 1-dodecyl-3-(4-methylphenyl)benzo[f][1]benzopyran-4-ium perchlorate IUPAC Name: 1-dodecyl-3-(4-methylphenyl)benzo[f]chromen-4-ium perchlorate Traditional Name: 1-lauryl-3-(p-tolyl)benzo[f]chromen-4-ium perchlorate Formula: C32H39ClO5 MolecularWeight: 539.10206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=[O+]C2=C1C3=CC=CC=C3C=C2)C4=CC=C(C=C4)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=[O+]C2=C1C3=CC=CC=C3C=C2)C4=CC=C(C=C4)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C32H39O.ClHO4/c1-3-4-5-6-7-8-9-10-11-12-16-28-24-31(27-20-18-25(2)19-21-27)33-30-23-22-26-15-13-14-17-29(26)32(28)30;2-1(3,4)5/h13-15,17-24H,3-12,16H2,1-2H3;(H,2,3,4,5)/q+1;/p-1