1-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid Openeye Name: 1-[(1R)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl]pyrazole-4-carboxylic acid Traditional Name: 1-[(1R)-2-[(4-fluorobenzyl)amino]-2-keto-1-methyl-ethyl]pyrazole-4-carboxylic acid Formula: C14H14FN3O3 MolecularWeight: 291.277663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)F)N2C=C(C=N2)C(=O)O

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=C(C=C1)F)N2C=C(C=N2)C(=O)O

InChI

InChI=1S/C14H14FN3O3/c1-9(18-8-11(7-17-18)14(20)21)13(19)16-6-10-2-4-12(15)5-3-10/h2-5,7-9H,6H2,1H3,(H,16,19)(H,20,21)/t9-/m1/s1