3-[2-oxidanylidene-3-[(3R,4R)-3-oxidanylpiperidin-4-yl]propyl]quinazolin-4-one

Systemtic Name: 3-[2-oxidanylidene-3-[(3R,4R)-3-oxidanylpiperidin-4-yl]propyl]quinazolin-4-one Openeye Name: 3-[3-[(3R,4R)-3-hydroxy-4-piperidyl]-2-oxo-propyl]quinazolin-4-one CAS Name: 3-[3-[(3R,4R)-3-hydroxy-4-piperidinyl]-2-oxopropyl]-4-quinazolinone IUPAC Name: 3-[3-[(3R,4R)-3-hydroxypiperidin-4-yl]-2-oxopropyl]quinazolin-4-one Traditional Name: 3-[3-[(3R,4R)-3-hydroxy-4-piperidyl]-2-keto-propyl]quinazolin-4-one Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1CC(=O)CN2C=NC3=CC=CC=C3C2=O)O

Isomeric SMILES

C1CNC[C@@H]([C@H]1CC(=O)CN2C=NC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C16H19N3O3/c20-12(7-11-5-6-17-8-15(11)21)9-19-10-18-14-4-2-1-3-13(14)16(19)22/h1-4,10-11,15,17,21H,5-9H2/t11-,15+/m1/s1