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

Systemtic Name: 8-methyl-3-[2-oxidanylidene-3-[(2R,3S)-3-oxidanylpiperidin-2-yl]propyl]quinazolin-4-one Openeye Name: 3-[3-[(2R,3S)-3-hydroxy-2-piperidyl]-2-oxo-propyl]-8-methyl-quinazolin-4-one CAS Name: 3-[3-[(2R,3S)-3-hydroxy-2-piperidinyl]-2-oxopropyl]-8-methyl-4-quinazolinone IUPAC Name: 3-[3-[(2R,3S)-3-hydroxypiperidin-2-yl]-2-oxopropyl]-8-methylquinazolin-4-one Traditional Name: 3-[3-[(2R,3S)-3-hydroxy-2-piperidyl]-2-keto-propyl]-8-methyl-quinazolin-4-one Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)CC3C(CCCN3)O

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CC(=O)C[C@@H]3[C@H](CCCN3)O

InChI

InChI=1S/C17H21N3O3/c1-11-4-2-5-13-16(11)19-10-20(17(13)23)9-12(21)8-14-15(22)6-3-7-18-14/h2,4-5,10,14-15,18,22H,3,6-9H2,1H3/t14-,15+/m1/s1