(2S)-1-[4-[2-(diethylazaniumyl)ethylamino]-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-[4-[2-(diethylazaniumyl)ethylamino]-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylate Openeye Name: (2S)-1-[4-[2-(diethylammonio)ethylamino]-4-oxo-butanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[4-[2-(diethylammonio)ethylamino]-1,4-dioxobutyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-[4-[2-(diethylazaniumyl)ethylamino]-4-oxobutanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[4-[2-(diethylammonio)ethylamino]-4-keto-butanoyl]pyrrolidine-2-carboxylate Formula: C15H27N3O4 MolecularWeight: 313.39258

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)CCC(=O)N1CCCC1C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCNC(=O)CCC(=O)N1CCC[C@H]1C(=O)[O-]

InChI

InChI=1S/C15H27N3O4/c1-3-17(4-2)11-9-16-13(19)7-8-14(20)18-10-5-6-12(18)15(21)22/h12H,3-11H2,1-2H3,(H,16,19)(H,21,22)/t12-/m0/s1