ethanedioic acid; 3-[(3-methyl-3-azabicyclo[2.2.2]octan-2-yl)methyl]-2-phenyl-1H-indole

Systemtic Name: ethanedioic acid; 3-[(3-methyl-3-azabicyclo[2.2.2]octan-2-yl)methyl]-2-phenyl-1H-indole Openeye Name: 3-[(3-methyl-3-azabicyclo[2.2.2]octan-2-yl)methyl]-2-phenyl-1H-indole; oxalic acid CAS Name: 3-[(3-methyl-3-azabicyclo[2.2.2]octan-2-yl)methyl]-2-phenyl-1H-indole; oxalic acid IUPAC Name: 3-[(3-methyl-3-azabicyclo[2.2.2]octan-2-yl)methyl]-2-phenyl-1H-indole; oxalic acid Traditional Name: 3-[(3-methyl-3-azabicyclo[2.2.2]octan-2-yl)methyl]-2-phenyl-1H-indole; oxalic acid Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC(C1CC3=C(NC4=CC=CC=C43)C5=CC=CC=C5)CC2.C(=O)(C(=O)O)O

Isomeric SMILES

CN1C2CCC(C1CC3=C(NC4=CC=CC=C43)C5=CC=CC=C5)CC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H26N2.C2H2O4/c1-25-18-13-11-16(12-14-18)22(25)15-20-19-9-5-6-10-21(19)24-23(20)17-7-3-2-4-8-17;3-1(4)2(5)6/h2-10,16,18,22,24H,11-15H2,1H3;(H,3,4)(H,5,6)