[4-(trifluoromethyl)phenyl]methyl 5-azanyl-4-oxidanylidene-pentanoate hydrochloride

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl 5-azanyl-4-oxidanylidene-pentanoate hydrochloride Openeye Name: [4-(trifluoromethyl)phenyl]methyl 5-amino-4-oxo-pentanoate hydrochloride CAS Name: 5-amino-4-oxopentanoic acid [4-(trifluoromethyl)phenyl]methyl ester hydrochloride IUPAC Name: [4-(trifluoromethyl)phenyl]methyl 5-amino-4-oxopentanoate hydrochloride Traditional Name: 5-amino-4-keto-valeric acid [4-(trifluoromethyl)benzyl] ester hydrochloride Formula: C13H15ClF3NO3 MolecularWeight: 325.71131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CCC(=O)CN)C(F)(F)F.Cl

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CCC(=O)CN)C(F)(F)F.Cl

InChI

InChI=1S/C13H14F3NO3.ClH/c14-13(15,16)10-3-1-9(2-4-10)8-20-12(19)6-5-11(18)7-17;/h1-4H,5-8,17H2;1H