3-(1-adamantyl)-1-methyl-2H-quinazolin-3-ium

Systemtic Name: 3-(1-adamantyl)-1-methyl-2H-quinazolin-3-ium Openeye Name: 3-(1-adamantyl)-1-methyl-2H-quinazolin-3-ium CAS Name: 3-(1-adamantyl)-1-methyl-2H-quinazolin-3-ium IUPAC Name: 3-(1-adamantyl)-1-methyl-2H-quinazolin-3-ium Traditional Name: 3-(1-adamantyl)-1-methyl-2H-quinazolin-3-ium Formula: C19H25N2+ MolecularWeight: 281.4152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C[N+](=CC2=CC=CC=C21)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C[N+](=CC2=CC=CC=C21)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C19H25N2/c1-20-13-21(12-17-4-2-3-5-18(17)20)19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,12,14-16H,6-11,13H2,1H3/q+1