(2S)-2-azanyl-3-[[(E)-6-methoxy-6-oxidanylidene-hex-1-enyl]amino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-azanyl-3-[[(E)-6-methoxy-6-oxidanylidene-hex-1-enyl]amino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-amino-3-[[(E)-6-methoxy-6-oxo-hex-1-enyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-amino-3-[[(E)-6-methoxy-6-oxohex-1-enyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-amino-3-[[(E)-6-methoxy-6-oxohex-1-enyl]amino]-4-methylpentanoic acid Traditional Name: (2S)-2-amino-3-[[(E)-6-keto-6-methoxy-hex-1-enyl]amino]-4-methyl-valeric acid Formula: C13H24N2O4 MolecularWeight: 272.34066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(=O)O)N)NC=CCCCC(=O)OC

Isomeric SMILES

CC(C)C([C@@H](C(=O)O)N)N/C=C/CCCC(=O)OC

InChI

InChI=1S/C13H24N2O4/c1-9(2)12(11(14)13(17)18)15-8-6-4-5-7-10(16)19-3/h6,8-9,11-12,15H,4-5,7,14H2,1-3H3,(H,17,18)/b8-6+/t11-,12?/m0/s1