2-[3-(methylamino)-2-oxidanylidene-7-propyl-azepan-1-yl]propanoic acid

Systemtic Name: 2-[3-(methylamino)-2-oxidanylidene-7-propyl-azepan-1-yl]propanoic acid Openeye Name: 2-[3-(methylamino)-2-oxo-7-propyl-azepan-1-yl]propanoic acid CAS Name: 2-[3-(methylamino)-2-oxo-7-propyl-1-azepanyl]propanoic acid IUPAC Name: 2-[3-(methylamino)-2-oxo-7-propylazepan-1-yl]propanoic acid Traditional Name: 2-[2-keto-3-(methylamino)-7-propyl-azepan-1-yl]propionic acid Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCCC(C(=O)N1C(C)C(=O)O)NC

Isomeric SMILES

CCCC1CCCC(C(=O)N1C(C)C(=O)O)NC

InChI

InChI=1S/C13H24N2O3/c1-4-6-10-7-5-8-11(14-3)12(16)15(10)9(2)13(17)18/h9-11,14H,4-8H2,1-3H3,(H,17,18)