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4,7-bis(oxidanylidene)-2-[(trimethylazaniumyl)methyl]oxepane-3-carboxylate

4,7-bis(oxidanylidene)-2-[(trimethylazaniumyl)methyl]oxepane-3-carboxylate

Systemtic Name:4,7-bis(oxidanylidene)-2-[(trimethylazaniumyl)methyl]oxepane-3-carboxylate
Openeye Name:4,7-dioxo-2-[(trimethylammonio)methyl]oxepane-3-carboxylate
CAS Name:4,7-dioxo-2-[(trimethylammonio)methyl]-3-oxepanecarboxylate
IUPAC Name:4,7-dioxo-2-[(trimethylazaniumyl)methyl]oxepane-3-carboxylate
Traditional Name:4,7-diketo-2-[(trimethylammonio)methyl]oxepane-3-carboxylate
Formula: C11H17NO5
MolecularWeight: 243.25638
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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1C(C(=O)CCC(=O)O1)C(=O)[O-]


Isomeric SMILES

C[N+](C)(C)CC1C(C(=O)CCC(=O)O1)C(=O)[O-]


InChI

InChI=1S/C11H17NO5/c1-12(2,3)6-8-10(11(15)16)7(13)4-5-9(14)17-8/h8,10H,4-6H2,1-3H3


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