(Z)-2-(1-azanyl-1-oxidanylidene-octan-3-yl)but-2-enedioic acid

Systemtic Name: (Z)-2-(1-azanyl-1-oxidanylidene-octan-3-yl)but-2-enedioic acid Openeye Name: (Z)-2-[1-(2-amino-2-oxo-ethyl)hexyl]but-2-enedioic acid CAS Name: (Z)-2-(1-amino-1-oxooctan-3-yl)-2-butenedioic acid IUPAC Name: (Z)-2-(1-amino-1-oxooctan-3-yl)but-2-enedioic acid Traditional Name: (Z)-2-[1-(2-amino-2-keto-ethyl)hexyl]but-2-enedioic acid Formula: C12H19NO5 MolecularWeight: 257.28296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)N)C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCC(CC(=O)N)/C(=C/C(=O)O)/C(=O)O

InChI

InChI=1S/C12H19NO5/c1-2-3-4-5-8(6-10(13)14)9(12(17)18)7-11(15)16/h7-8H,2-6H2,1H3,(H2,13,14)(H,15,16)(H,17,18)/b9-7-