4-[[5-[[(2S)-butan-2-yl]amino]pyridin-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[5-[[(2S)-butan-2-yl]amino]pyridin-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[5-[[(1S)-1-methylpropyl]amino]-2-pyridyl]amino]-4-oxo-butanoate CAS Name: 4-[[5-[[(2S)-butan-2-yl]amino]-2-pyridinyl]amino]-4-oxobutanoate IUPAC Name: 4-[[5-[[(2S)-butan-2-yl]amino]pyridin-2-yl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[5-[[(1S)-1-methylpropyl]amino]-2-pyridyl]amino]butyrate Formula: C13H18N3O3- MolecularWeight: 264.30032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=CN=C(C=C1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC[C@H](C)NC1=CN=C(C=C1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H19N3O3/c1-3-9(2)15-10-4-5-11(14-8-10)16-12(17)6-7-13(18)19/h4-5,8-9,15H,3,6-7H2,1-2H3,(H,18,19)(H,14,16,17)/p-1/t9-/m0/s1