(3R,4S)-3-(dioxidanyl)-3,4-diphenyl-4H-isochromen-2-ium

Systemtic Name: (3R,4S)-3-(dioxidanyl)-3,4-diphenyl-4H-isochromen-2-ium Openeye Name: (3R,4S)-3-hydroperoxy-3,4-diphenyl-4H-isochromen-2-ium CAS Name: (3R,4S)-3-hydroperoxy-3,4-diphenyl-4H-2-benzopyran-2-ium IUPAC Name: (3R,4S)-3-hydroperoxy-3,4-diphenyl-4H-isochromen-2-ium Traditional Name: (3R,4S)-3-hydroperoxy-3,4-diphenyl-4H-isochromen-2-ium Formula: C21H17O3+ MolecularWeight: 317.35788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C3=CC=CC=C3C=[O+]C2(C4=CC=CC=C4)OO

Isomeric SMILES

C1=CC=C(C=C1)[C@H]2C3=CC=CC=C3C=[O+][C@@]2(C4=CC=CC=C4)OO

InChI

InChI=1S/C21H16O3/c22-24-21(18-12-5-2-6-13-18)20(16-9-3-1-4-10-16)19-14-8-7-11-17(19)15-23-21/h1-15,20H/p+1/t20-,21-/m0/s1