methyl (Z)-6-[(4R,6S)-6-butoxy-3-methyl-2-oxidanidyl-5,6-dihydro-4H-1,2-oxazin-2-ium-4-yl]hex-2-enoate

Systemtic Name: methyl (Z)-6-[(4R,6S)-6-butoxy-3-methyl-2-oxidanidyl-5,6-dihydro-4H-1,2-oxazin-2-ium-4-yl]hex-2-enoate Openeye Name: methyl (Z)-6-[(4R,6S)-6-butoxy-3-methyl-2-oxido-5,6-dihydro-4H-oxazin-2-ium-4-yl]hex-2-enoate CAS Name: (Z)-6-[(4R,6S)-6-butoxy-3-methyl-2-oxido-5,6-dihydro-4H-oxazin-2-ium-4-yl]-2-hexenoic acid methyl ester IUPAC Name: methyl (Z)-6-[(4R,6S)-6-butoxy-3-methyl-2-oxido-5,6-dihydro-4H-oxazin-2-ium-4-yl]hex-2-enoate Traditional Name: (Z)-6-[(4R,6S)-6-butoxy-3-methyl-2-oxido-5,6-dihydro-4H-oxazin-2-ium-4-yl]hex-2-enoic acid methyl ester Formula: C16H27NO5 MolecularWeight: 313.38928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1CC(C(=[N+](O1)[O-])C)CCCC=CC(=O)OC

Isomeric SMILES

CCCCO[C@@H]1C[C@H](C(=[N+](O1)[O-])C)CCC/C=C\C(=O)OC

InChI

InChI=1S/C16H27NO5/c1-4-5-11-21-16-12-14(13(2)17(19)22-16)9-7-6-8-10-15(18)20-3/h8,10,14,16H,4-7,9,11-12H2,1-3H3/b10-8-/t14-,16+/m1/s1