(2S)-2-azanyl-5-(ethylamino)-5-oxidanylidene-pentanoic acid; (E)-but-2-enedioic acid

Systemtic Name: (2S)-2-azanyl-5-(ethylamino)-5-oxidanylidene-pentanoic acid; (E)-but-2-enedioic acid Openeye Name: (2S)-2-amino-5-(ethylamino)-5-oxo-pentanoic acid; fumaric acid CAS Name: (2S)-2-amino-5-(ethylamino)-5-oxopentanoic acid; (E)-2-butenedioic acid IUPAC Name: (2S)-2-amino-5-(ethylamino)-5-oxopentanoic acid; (E)-but-2-enedioic acid Traditional Name: (2S)-2-amino-5-(ethylamino)-5-keto-valeric acid; fumaric acid Formula: C11H18N2O7 MolecularWeight: 290.26982

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CCC(C(=O)O)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCNC(=O)CC[C@@H](C(=O)O)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C7H14N2O3.C4H4O4/c1-2-9-6(10)4-3-5(8)7(11)12;5-3(6)1-2-4(7)8/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12);1-2H,(H,5,6)(H,7,8)/b;2-1+/t5-;/m0./s1