(2R)-5-azanyl-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]azaniumyl]-5-oxidanylidene-pentanoate

Systemtic Name: (2R)-5-azanyl-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]azaniumyl]-5-oxidanylidene-pentanoate Openeye Name: (2R)-5-amino-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]ammonio]-5-oxo-pentanoate CAS Name: (2R)-5-amino-2-[[6-methyl-2-(trifluoromethyl)-4-quinazolinyl]ammonio]-5-oxopentanoate IUPAC Name: (2R)-5-amino-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]azaniumyl]-5-oxopentanoate Traditional Name: (2R)-5-amino-5-keto-2-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]ammonio]valerate Formula: C15H15F3N4O3 MolecularWeight: 356.29981

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2[NH2+]C(CCC(=O)N)C(=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2[NH2+][C@H](CCC(=O)N)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H15F3N4O3/c1-7-2-3-9-8(6-7)12(22-14(21-9)15(16,17)18)20-10(13(24)25)4-5-11(19)23/h2-3,6,10H,4-5H2,1H3,(H2,19,23)(H,24,25)(H,20,21,22)/t10-/m1/s1