[6-[[(2S)-2-azanyl-3-methyl-butanoyl]oxymethyl]pyridin-2-yl]methyl (2S)-2-azanyl-3-methyl-butanoate

Systemtic Name: [6-[[(2S)-2-azanyl-3-methyl-butanoyl]oxymethyl]pyridin-2-yl]methyl (2S)-2-azanyl-3-methyl-butanoate Openeye Name: [6-[[(2S)-2-amino-3-methyl-butanoyl]oxymethyl]-2-pyridyl]methyl (2S)-2-amino-3-methyl-butanoate CAS Name: (2S)-2-amino-3-methylbutanoic acid [6-[[(2S)-2-amino-3-methyl-1-oxobutoxy]methyl]-2-pyridinyl]methyl ester IUPAC Name: [6-[[(2S)-2-amino-3-methylbutanoyl]oxymethyl]pyridin-2-yl]methyl (2S)-2-amino-3-methylbutanoate Traditional Name: (2S)-2-amino-3-methyl-butyric acid [6-[[(2S)-2-amino-3-methyl-butanoyl]oxymethyl]-2-pyridyl]methyl ester Formula: C17H27N3O4 MolecularWeight: 337.41398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=NC(=CC=C1)COC(=O)C(C(C)C)N)N

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=NC(=CC=C1)COC(=O)[C@H](C(C)C)N)N

InChI

InChI=1S/C17H27N3O4/c1-10(2)14(18)16(21)23-8-12-6-5-7-13(20-12)9-24-17(22)15(19)11(3)4/h5-7,10-11,14-15H,8-9,18-19H2,1-4H3/t14-,15-/m0/s1