(2S)-2-[[4-[2-(dimethylazaniumyl)ethylamino]-4-oxidanylidene-butanoyl]amino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[[4-[2-(dimethylazaniumyl)ethylamino]-4-oxidanylidene-butanoyl]amino]-4-methyl-pentanoate Openeye Name: (2S)-2-[[4-[2-(dimethylammonio)ethylamino]-4-oxo-butanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[4-[2-(dimethylammonio)ethylamino]-1,4-dioxobutyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[[4-[2-(dimethylazaniumyl)ethylamino]-4-oxobutanoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[4-[2-(dimethylammonio)ethylamino]-4-keto-butanoyl]amino]-4-methyl-valerate Formula: C14H27N3O4 MolecularWeight: 301.38188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)CCC(=O)NCC[NH+](C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)CCC(=O)NCC[NH+](C)C

InChI

InChI=1S/C14H27N3O4/c1-10(2)9-11(14(20)21)16-13(19)6-5-12(18)15-7-8-17(3)4/h10-11H,5-9H2,1-4H3,(H,15,18)(H,16,19)(H,20,21)/t11-/m0/s1