2-[3-[4-(4-pyridin-1-ium-1-ylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]-1H-quinazolin-4-one

Systemtic Name: 2-[3-[4-(4-pyridin-1-ium-1-ylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]-1H-quinazolin-4-one Openeye Name: 2-[3-[4-(4-pyridin-1-ium-1-ylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]-1H-quinazolin-4-one CAS Name: 2-[3-[4-[4-(1-pyridin-1-iumyl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]propyl]-1H-quinazolin-4-one IUPAC Name: 2-[3-[4-(4-pyridin-1-ium-1-ylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]-1H-quinazolin-4-one Traditional Name: 2-[3-[4-(4-pyridin-1-ium-1-ylphenyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]-1H-quinazolin-4-one Formula: C27H27N4O+ MolecularWeight: 423.52948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=C(C=C2)[N+]3=CC=CC=C3)CCCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1CN(CC=C1C2=CC=C(C=C2)[N+]3=CC=CC=C3)CCCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C27H26N4O/c32-27-24-7-2-3-8-25(24)28-26(29-27)9-6-16-30-19-14-22(15-20-30)21-10-12-23(13-11-21)31-17-4-1-5-18-31/h1-5,7-8,10-14,17-18H,6,9,15-16,19-20H2/p+1