3-(diphenylmethylidene)-1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane

Systemtic Name: 3-(diphenylmethylidene)-1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane Openeye Name: 3-benzhydrylidene-1-benzyl-quinuclidin-1-ium CAS Name: 3-(diphenylmethylene)-1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane IUPAC Name: 3-benzhydrylidene-1-benzyl-1-azoniabicyclo[2.2.2]octane Traditional Name: 3-benzhydrylidene-1-benzyl-quinuclidin-1-ium Formula: C27H28N+ MolecularWeight: 366.51792

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1C(=C(C3=CC=CC=C3)C4=CC=CC=C4)C2)CC5=CC=CC=C5

Isomeric SMILES

C1C[N+]2(CCC1C(=C(C3=CC=CC=C3)C4=CC=CC=C4)C2)CC5=CC=CC=C5

InChI

InChI=1S/C27H28N/c1-4-10-22(11-5-1)20-28-18-16-23(17-19-28)26(21-28)27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,23H,16-21H2/q+1