3-(4-decoxyphenyl)isochromenylium

Systemtic Name: 3-(4-decoxyphenyl)isochromenylium Openeye Name: 3-(4-decoxyphenyl)isochromenylium CAS Name: 3-(4-decoxyphenyl)-2-benzopyrylium IUPAC Name: 3-(4-decoxyphenyl)isochromenylium Traditional Name: 3-(4-decoxyphenyl)-2-benzopyrylium Formula: C25H31O2+ MolecularWeight: 363.51244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC3=CC=CC=C3C=[O+]2

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC3=CC=CC=C3C=[O+]2

InChI

InChI=1S/C25H31O2/c1-2-3-4-5-6-7-8-11-18-26-24-16-14-21(15-17-24)25-19-22-12-9-10-13-23(22)20-27-25/h9-10,12-17,19-20H,2-8,11,18H2,1H3/q+1