2-[(1R)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one Formula: C21H22N3O+ MolecularWeight: 332.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)[NH+]3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)[NH+]3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O/c1-15(20-22-19-10-6-5-9-18(19)21(25)23-20)24-13-11-17(12-14-24)16-7-3-2-4-8-16/h2-11,15H,12-14H2,1H3,(H,22,23,25)/p+1/t15-/m1/s1