(2S,3R)-3-methyl-2-(pyridin-3-ylmethylcarbamoylamino)pentanoate

Systemtic Name: (2S,3R)-3-methyl-2-(pyridin-3-ylmethylcarbamoylamino)pentanoate Openeye Name: (2S,3R)-3-methyl-2-(3-pyridylmethylcarbamoylamino)pentanoate CAS Name: (2S,3R)-3-methyl-2-[[oxo-(3-pyridinylmethylamino)methyl]amino]pentanoate IUPAC Name: (2S,3R)-3-methyl-2-(pyridin-3-ylmethylcarbamoylamino)pentanoate Traditional Name: (2S,3R)-3-methyl-2-(3-pyridylmethylcarbamoylamino)valerate Formula: C13H18N3O3- MolecularWeight: 264.30032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)NCC1=CN=CC=C1

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)[O-])NC(=O)NCC1=CN=CC=C1

InChI

InChI=1S/C13H19N3O3/c1-3-9(2)11(12(17)18)16-13(19)15-8-10-5-4-6-14-7-10/h4-7,9,11H,3,8H2,1-2H3,(H,17,18)(H2,15,16,19)/p-1/t9-,11+/m1/s1