1-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl]pyrazole-3-carboxylic acid Openeye Name: 1-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]pyrazole-3-carboxylic acid CAS Name: 1-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]pyrazole-3-carboxylic acid Traditional Name: 1-[2-keto-2-[[(1S)-1-phenylethyl]amino]ethyl]pyrazole-3-carboxylic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CN2C=CC(=N2)C(=O)O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)CN2C=CC(=N2)C(=O)O

InChI

InChI=1S/C14H15N3O3/c1-10(11-5-3-2-4-6-11)15-13(18)9-17-8-7-12(16-17)14(19)20/h2-8,10H,9H2,1H3,(H,15,18)(H,19,20)/t10-/m0/s1