2-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]oxyethyl 6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: 2-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]oxyethyl 6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: 2-[(2S,3S)-2-amino-3-methyl-pentanoyl]oxyethyl 6-oxo-1H-pyridine-3-carboxylate CAS Name: 6-oxo-1H-pyridine-3-carboxylic acid 2-[(2S,3S)-2-amino-3-methyl-1-oxopentoxy]ethyl ester IUPAC Name: 2-[(2S,3S)-2-amino-3-methylpentanoyl]oxyethyl 6-oxo-1H-pyridine-3-carboxylate Traditional Name: 6-keto-1H-pyridine-3-carboxylic acid 2-[(2S,3S)-2-amino-3-methyl-pentanoyl]oxyethyl ester Formula: C14H20N2O5 MolecularWeight: 296.319

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCCOC(=O)C1=CNC(=O)C=C1)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OCCOC(=O)C1=CNC(=O)C=C1)N

InChI

InChI=1S/C14H20N2O5/c1-3-9(2)12(15)14(19)21-7-6-20-13(18)10-4-5-11(17)16-8-10/h4-5,8-9,12H,3,6-7,15H2,1-2H3,(H,16,17)/t9-,12-/m0/s1