2-[(1R)-1-(4-ethanoylpiperazin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-(4-ethanoylpiperazin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-(4-acetylpiperazin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-(4-acetyl-1-piperazin-1-iumyl)ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-(4-acetylpiperazin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-(4-acetylpiperazin-1-ium-1-yl)ethyl]-1H-quinazolin-4-one Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O2/c1-11(19-7-9-20(10-8-19)12(2)21)15-17-14-6-4-3-5-13(14)16(22)18-15/h3-6,11H,7-10H2,1-2H3,(H,17,18,22)/p+1/t11-/m1/s1