2-[2-chloranyl-2-(trimethylazaniumyl)ethyl]-6-methoxy-3,6-bis(oxidanylidene)hexanoate

Systemtic Name: 2-[2-chloranyl-2-(trimethylazaniumyl)ethyl]-6-methoxy-3,6-bis(oxidanylidene)hexanoate Openeye Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-6-methoxy-3,6-dioxo-hexanoate CAS Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-6-methoxy-3,6-dioxohexanoate IUPAC Name: 2-[2-chloro-2-(trimethylazaniumyl)ethyl]-6-methoxy-3,6-dioxohexanoate Traditional Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-3,6-diketo-6-methoxy-hexanoate Formula: C12H20ClNO5 MolecularWeight: 293.7439

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC(C(=O)CCC(=O)OC)C(=O)[O-])Cl

Isomeric SMILES

C[N+](C)(C)C(CC(C(=O)CCC(=O)OC)C(=O)[O-])Cl

InChI

InChI=1S/C12H20ClNO5/c1-14(2,3)10(13)7-8(12(17)18)9(15)5-6-11(16)19-4/h8,10H,5-7H2,1-4H3