1,3-diphenyl-5,6,7,8-tetrahydroisochromen-2-ium

Systemtic Name: 1,3-diphenyl-5,6,7,8-tetrahydroisochromen-2-ium Openeye Name: 1,3-diphenyl-5,6,7,8-tetrahydroisochromen-2-ium CAS Name: 1,3-diphenyl-5,6,7,8-tetrahydro-2-benzopyran-2-ium IUPAC Name: 1,3-diphenyl-5,6,7,8-tetrahydroisochromen-2-ium Traditional Name: 1,3-diphenyl-5,6,7,8-tetrahydroisochromen-2-ium Formula: C21H19O+ MolecularWeight: 287.37496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C([O+]=C(C=C2C1)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C([O+]=C(C=C2C1)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H19O/c1-3-9-16(10-4-1)20-15-18-13-7-8-14-19(18)21(22-20)17-11-5-2-6-12-17/h1-6,9-12,15H,7-8,13-14H2/q+1