(2S,3S)-2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-3-methyl-pentanoate Openeye Name: (2S,3S)-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-3-methylpentanoate Traditional Name: (2S,3S)-2-(2,3-dihydro-p-dioxin-5-carbonylamino)-3-methyl-valerate Formula: C11H16NO5- MolecularWeight: 242.24844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C1=COCCO1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)C1=COCCO1

InChI

InChI=1S/C11H17NO5/c1-3-7(2)9(11(14)15)12-10(13)8-6-16-4-5-17-8/h6-7,9H,3-5H2,1-2H3,(H,12,13)(H,14,15)/p-1/t7-,9-/m0/s1