1-(4-chloranylbutyl)-3-(4-methoxyphenyl)benzo[f]chromen-4-ium perchlorate

Systemtic Name: 1-(4-chloranylbutyl)-3-(4-methoxyphenyl)benzo[f]chromen-4-ium perchlorate Openeye Name: 1-(4-chlorobutyl)-3-(4-methoxyphenyl)benzo[f]chromen-4-ium perchlorate CAS Name: 1-(4-chlorobutyl)-3-(4-methoxyphenyl)benzo[f][1]benzopyran-4-ium perchlorate IUPAC Name: 1-(4-chlorobutyl)-3-(4-methoxyphenyl)benzo[f]chromen-4-ium perchlorate Traditional Name: 1-(4-chlorobutyl)-3-(4-methoxyphenyl)benzo[f]chromen-4-ium perchlorate Formula: C24H22Cl2O6 MolecularWeight: 477.33388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=[O+]C3=C(C4=CC=CC=C4C=C3)C(=C2)CCCCCl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=[O+]C3=C(C4=CC=CC=C4C=C3)C(=C2)CCCCCl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C24H22ClO2.ClHO4/c1-26-20-12-9-18(10-13-20)23-16-19(7-4-5-15-25)24-21-8-3-2-6-17(21)11-14-22(24)27-23;2-1(3,4)5/h2-3,6,8-14,16H,4-5,7,15H2,1H3;(H,2,3,4,5)/q+1;/p-1