3-[2-oxidanylidene-3-[(2R,3S)-3-oxidanylpyrrolidin-2-yl]propyl]-6-(trifluoromethyl)quinazolin-4-one

Systemtic Name: 3-[2-oxidanylidene-3-[(2R,3S)-3-oxidanylpyrrolidin-2-yl]propyl]-6-(trifluoromethyl)quinazolin-4-one Openeye Name: 3-[3-[(2R,3S)-3-hydroxypyrrolidin-2-yl]-2-oxo-propyl]-6-(trifluoromethyl)quinazolin-4-one CAS Name: 3-[3-[(2R,3S)-3-hydroxy-2-pyrrolidinyl]-2-oxopropyl]-6-(trifluoromethyl)-4-quinazolinone IUPAC Name: 3-[3-[(2R,3S)-3-hydroxypyrrolidin-2-yl]-2-oxopropyl]-6-(trifluoromethyl)quinazolin-4-one Traditional Name: 3-[3-[(2R,3S)-3-hydroxypyrrolidin-2-yl]-2-keto-propyl]-6-(trifluoromethyl)quinazolin-4-one Formula: C16H16F3N3O3 MolecularWeight: 355.31175

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C1O)CC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN[C@@H]([C@H]1O)CC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H16F3N3O3/c17-16(18,19)9-1-2-12-11(5-9)15(25)22(8-21-12)7-10(23)6-13-14(24)3-4-20-13/h1-2,5,8,13-14,20,24H,3-4,6-7H2/t13-,14+/m1/s1