[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate

Systemtic Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)C1=CN=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c1-3-9(2)15-13(19)16-11(17)8-20-12(18)10-5-4-6-14-7-10/h4-7,9H,3,8H2,1-2H3,(H2,15,16,17,19)/t9-/m0/s1