3-(3-bromanyl-5-methoxy-9H-xanthen-9-yl)-8-azabicyclo[3.2.1]octane

Systemtic Name: 3-(3-bromanyl-5-methoxy-9H-xanthen-9-yl)-8-azabicyclo[3.2.1]octane Openeye Name: 3-(3-bromo-5-methoxy-9H-xanthen-9-yl)-8-azabicyclo[3.2.1]octane CAS Name: 3-(3-bromo-5-methoxy-9H-xanthen-9-yl)-8-azabicyclo[3.2.1]octane IUPAC Name: 3-(3-bromo-5-methoxy-9H-xanthen-9-yl)-8-azabicyclo[3.2.1]octane Traditional Name: 3-(3-bromo-5-methoxy-9H-xanthen-9-yl)-8-azabicyclo[3.2.1]octane Formula: C21H22BrNO2 MolecularWeight: 400.30888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=C(C2C4CC5CCC(C4)N5)C=CC(=C3)Br

Isomeric SMILES

COC1=CC=CC2=C1OC3=C(C2C4CC5CCC(C4)N5)C=CC(=C3)Br

InChI

InChI=1S/C21H22BrNO2/c1-24-18-4-2-3-17-20(12-9-14-6-7-15(10-12)23-14)16-8-5-13(22)11-19(16)25-21(17)18/h2-5,8,11-12,14-15,20,23H,6-7,9-10H2,1H3