2-[2-chloranyl-2-(trimethylazaniumyl)ethyl]-7-methoxy-3,7-bis(oxidanylidene)heptanoate

Systemtic Name: 2-[2-chloranyl-2-(trimethylazaniumyl)ethyl]-7-methoxy-3,7-bis(oxidanylidene)heptanoate Openeye Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-7-methoxy-3,7-dioxo-heptanoate CAS Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-7-methoxy-3,7-dioxoheptanoate IUPAC Name: 2-[2-chloro-2-(trimethylazaniumyl)ethyl]-7-methoxy-3,7-dioxoheptanoate Traditional Name: 2-[2-chloro-2-(trimethylammonio)ethyl]-3,7-diketo-7-methoxy-enanthate Formula: C13H22ClNO5 MolecularWeight: 307.77048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22ClNO5/c1-15(2,3)11(14)8-9(13(18)19)10(16)6-5-7-12(17)20-4/h9,11H,5-8H2,1-4H3