3-bromanyl-9-tert-butyl-8,9,10,11-tetrahydrobenzo[a]xanthen-7-ium

Systemtic Name: 3-bromanyl-9-tert-butyl-8,9,10,11-tetrahydrobenzo[a]xanthen-7-ium Openeye Name: 3-bromo-9-tert-butyl-8,9,10,11-tetrahydrobenzo[a]xanthen-7-ium CAS Name: 3-bromo-9-tert-butyl-8,9,10,11-tetrahydrobenzo[a]xanthen-7-ium IUPAC Name: 3-bromo-9-tert-butyl-8,9,10,11-tetrahydrobenzo[a]xanthen-7-ium Traditional Name: 3-bromo-9-tert-butyl-8,9,10,11-tetrahydrobenzo[a]xanthen-7-ium Formula: C21H22BrO+ MolecularWeight: 370.30278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)[O+]=C3C=CC4=C(C3=C2)C=CC(=C4)Br

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)[O+]=C3C=CC4=C(C3=C2)C=CC(=C4)Br

InChI

InChI=1S/C21H22BrO/c1-21(2,3)15-6-4-14-11-18-17-8-7-16(22)10-13(17)5-9-19(18)23-20(14)12-15/h5,7-11,15H,4,6,12H2,1-3H3/q+1