8-(1-adamantyl)-1,3-diphenyl-2H-quinazolin-3-ium

Systemtic Name: 8-(1-adamantyl)-1,3-diphenyl-2H-quinazolin-3-ium Openeye Name: 8-(1-adamantyl)-1,3-diphenyl-2H-quinazolin-3-ium CAS Name: 8-(1-adamantyl)-1,3-diphenyl-2H-quinazolin-3-ium IUPAC Name: 8-(1-adamantyl)-1,3-diphenyl-2H-quinazolin-3-ium Traditional Name: 8-(1-adamantyl)-1,3-diphenyl-2H-quinazolin-3-ium Formula: C30H31N2+ MolecularWeight: 419.58054

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=CC5=C4N(C[N+](=C5)C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=CC5=C4N(C[N+](=C5)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C30H31N2/c1-3-9-26(10-4-1)31-20-25-8-7-13-28(29(25)32(21-31)27-11-5-2-6-12-27)30-17-22-14-23(18-30)16-24(15-22)19-30/h1-13,20,22-24H,14-19,21H2/q+1