4-azanyl-2-(2-ethylhexanoylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-(2-ethylhexanoylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-(2-ethylhexanoylamino)-4-oxo-butanoic acid CAS Name: 4-amino-2-[(2-ethyl-1-oxohexyl)amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-(2-ethylhexanoylamino)-4-oxobutanoic acid Traditional Name: 4-amino-2-(2-ethylhexanoylamino)-4-keto-butyric acid Formula: C12H22N2O4 MolecularWeight: 258.31408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

CCCCC(CC)C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C12H22N2O4/c1-3-5-6-8(4-2)11(16)14-9(12(17)18)7-10(13)15/h8-9H,3-7H2,1-2H3,(H2,13,15)(H,14,16)(H,17,18)