8-phenethyl-3-[3-(2H-1,2,3,4-tetrazol-5-yl)-9H-xanthen-9-yl]-8-azabicyclo[3.2.1]octane

Systemtic Name: 8-phenethyl-3-[3-(2H-1,2,3,4-tetrazol-5-yl)-9H-xanthen-9-yl]-8-azabicyclo[3.2.1]octane Openeye Name: 8-phenethyl-3-[3-(2H-tetrazol-5-yl)-9H-xanthen-9-yl]-8-azabicyclo[3.2.1]octane CAS Name: 8-phenethyl-3-[3-(2H-tetrazol-5-yl)-9H-xanthen-9-yl]-8-azabicyclo[3.2.1]octane IUPAC Name: 8-phenethyl-3-[3-(2H-tetrazol-5-yl)-9H-xanthen-9-yl]-8-azabicyclo[3.2.1]octane Traditional Name: 8-phenethyl-3-[3-(2H-tetrazol-5-yl)-9H-xanthen-9-yl]-8-azabicyclo[3.2.1]octane Formula: C29H29N5O MolecularWeight: 463.57346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2CCC3=CC=CC=C3)C4C5=C(C=C(C=C5)C6=NNN=N6)OC7=CC=CC=C47

Isomeric SMILES

C1CC2CC(CC1N2CCC3=CC=CC=C3)C4C5=C(C=C(C=C5)C6=NNN=N6)OC7=CC=CC=C47

InChI

InChI=1S/C29H29N5O/c1-2-6-19(7-3-1)14-15-34-22-11-12-23(34)17-21(16-22)28-24-8-4-5-9-26(24)35-27-18-20(10-13-25(27)28)29-30-32-33-31-29/h1-10,13,18,21-23,28H,11-12,14-17H2,(H,30,31,32,33)