sodium (2S)-2-azanyl-5-(ethylamino)-5-oxidanylidene-pentanoate

Systemtic Name: sodium (2S)-2-azanyl-5-(ethylamino)-5-oxidanylidene-pentanoate Openeye Name: sodium (2S)-2-amino-5-(ethylamino)-5-oxo-pentanoate CAS Name: sodium (2S)-2-amino-5-(ethylamino)-5-oxopentanoate IUPAC Name: sodium (2S)-2-amino-5-(ethylamino)-5-oxopentanoate Traditional Name: sodium (2S)-2-amino-5-(ethylamino)-5-keto-valerate Formula: C7H13N2NaO3 MolecularWeight: 196.17949

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CCC(C(=O)[O-])N.[Na+]

Isomeric SMILES

CCNC(=O)CC[C@@H](C(=O)[O-])N.[Na+]

InChI

InChI=1S/C7H14N2O3.Na/c1-2-9-6(10)4-3-5(8)7(11)12;/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12);/q;+1/p-1/t5-;/m0./s1