(8-phenethyl-8-azabicyclo[4.3.1]decan-10-yl) 9H-xanthene-9-carboxylate

Systemtic Name: (8-phenethyl-8-azabicyclo[4.3.1]decan-10-yl) 9H-xanthene-9-carboxylate Openeye Name: (8-phenethyl-8-azabicyclo[4.3.1]decan-10-yl) 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid (8-phenethyl-8-azabicyclo[4.3.1]decan-10-yl) ester IUPAC Name: (8-phenethyl-8-azabicyclo[4.3.1]decan-10-yl) 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid (8-phenethyl-8-azabicyclo[4.3.1]decan-10-yl) ester Formula: C31H33NO3 MolecularWeight: 467.59862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CC(C1)C2OC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)CCC6=CC=CC=C6

Isomeric SMILES

C1CCC2CN(CC(C1)C2OC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)CCC6=CC=CC=C6

InChI

InChI=1S/C31H33NO3/c33-31(29-25-14-6-8-16-27(25)34-28-17-9-7-15-26(28)29)35-30-23-12-4-5-13-24(30)21-32(20-23)19-18-22-10-2-1-3-11-22/h1-3,6-11,14-17,23-24,29-30H,4-5,12-13,18-21H2