2,4-diphenyl-5,6-dihydrobenzo[h]chromen-1-ium bromide

Systemtic Name: 2,4-diphenyl-5,6-dihydrobenzo[h]chromen-1-ium bromide Openeye Name: 2,4-diphenyl-5,6-dihydrobenzo[h]chromen-1-ium bromide CAS Name: 2,4-diphenyl-5,6-dihydrobenzo[h][1]benzopyran-1-ium bromide IUPAC Name: 2,4-diphenyl-5,6-dihydrobenzo[h]chromen-1-ium bromide Traditional Name: 2,4-diphenyl-5,6-dihydrobenzo[h]chromen-1-ium bromide Formula: C25H19BrO MolecularWeight: 415.32176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)[O+]=C(C=C2C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)[O+]=C(C=C2C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C25H19O.BrH/c1-3-9-18(10-4-1)23-17-24(20-12-5-2-6-13-20)26-25-21-14-8-7-11-19(21)15-16-22(23)25;/h1-14,17H,15-16H2;1H/q+1;/p-1