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

Systemtic Name: 3-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]oxypropyl 6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: 3-[(2S,3S)-2-amino-3-methyl-pentanoyl]oxypropyl 6-oxo-1H-pyridine-3-carboxylate CAS Name: 6-oxo-1H-pyridine-3-carboxylic acid 3-[(2S,3S)-2-amino-3-methyl-1-oxopentoxy]propyl ester IUPAC Name: 3-[(2S,3S)-2-amino-3-methylpentanoyl]oxypropyl 6-oxo-1H-pyridine-3-carboxylate Traditional Name: 6-keto-1H-pyridine-3-carboxylic acid 3-[(2S,3S)-2-amino-3-methyl-pentanoyl]oxypropyl ester Formula: C15H22N2O5 MolecularWeight: 310.34558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O5/c1-3-10(2)13(16)15(20)22-8-4-7-21-14(19)11-5-6-12(18)17-9-11/h5-6,9-10,13H,3-4,7-8,16H2,1-2H3,(H,17,18)/t10-,13-/m0/s1