(2S)-5-oxidanylidene-2-propan-2-yl-5-(pyridin-2-ylamino)pentanoate

Systemtic Name: (2S)-5-oxidanylidene-2-propan-2-yl-5-(pyridin-2-ylamino)pentanoate Openeye Name: (2S)-2-isopropyl-5-oxo-5-(2-pyridylamino)pentanoate CAS Name: (2S)-5-oxo-2-propan-2-yl-5-(2-pyridinylamino)pentanoate IUPAC Name: (2S)-5-oxo-2-propan-2-yl-5-(pyridin-2-ylamino)pentanoate Traditional Name: (2S)-2-isopropyl-5-keto-5-(2-pyridylamino)valerate Formula: C13H17N2O3- MolecularWeight: 249.28568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(=O)NC1=CC=CC=N1)C(=O)[O-]

Isomeric SMILES

CC(C)[C@H](CCC(=O)NC1=CC=CC=N1)C(=O)[O-]

InChI

InChI=1S/C13H18N2O3/c1-9(2)10(13(17)18)6-7-12(16)15-11-5-3-4-8-14-11/h3-5,8-10H,6-7H2,1-2H3,(H,17,18)(H,14,15,16)/p-1/t10-/m0/s1