phenyl-[1-[(4-phenylquinazolin-2-yl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: phenyl-[1-[(4-phenylquinazolin-2-yl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: phenyl-[1-[(4-phenylquinazolin-2-yl)methyl]piperidin-1-ium-4-yl]methanone CAS Name: phenyl-[1-[(4-phenyl-2-quinazolinyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: phenyl-[1-[(4-phenylquinazolin-2-yl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: phenyl-[1-[(4-phenylquinazolin-2-yl)methyl]piperidin-1-ium-4-yl]methanone Formula: C27H26N3O+ MolecularWeight: 408.51484

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O/c31-27(21-11-5-2-6-12-21)22-15-17-30(18-16-22)19-25-28-24-14-8-7-13-23(24)26(29-25)20-9-3-1-4-10-20/h1-14,22H,15-19H2/p+1