methyl (E,2S)-8-acetyloxy-2-[(3-methoxy-3-oxidanylidene-propanoyl)amino]oct-6-enoate

Systemtic Name: methyl (E,2S)-8-acetyloxy-2-[(3-methoxy-3-oxidanylidene-propanoyl)amino]oct-6-enoate Openeye Name: methyl (E,2S)-8-acetoxy-2-[(3-methoxy-3-oxo-propanoyl)amino]oct-6-enoate CAS Name: (E,2S)-8-acetyloxy-2-[(3-methoxy-1,3-dioxopropyl)amino]-6-octenoic acid methyl ester IUPAC Name: methyl (E,2S)-8-acetyloxy-2-[(3-methoxy-3-oxopropanoyl)amino]oct-6-enoate Traditional Name: (E,2S)-8-acetoxy-2-[(3-keto-3-methoxy-propanoyl)amino]oct-6-enoic acid methyl ester Formula: C15H23NO7 MolecularWeight: 329.34562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)OC/C=C/CCC[C@@H](C(=O)OC)NC(=O)CC(=O)OC

InChI

InChI=1S/C15H23NO7/c1-11(17)23-9-7-5-4-6-8-12(15(20)22-3)16-13(18)10-14(19)21-2/h5,7,12H,4,6,8-10H2,1-3H3,(H,16,18)/b7-5+/t12-/m0/s1