2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-3-methyl-pentanoic acid

Systemtic Name: 2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-3-methyl-pentanoic acid Openeye Name: 2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-3-methyl-pentanoic acid CAS Name: 2-[[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]amino]-3-methylpentanoic acid IUPAC Name: 2-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-3-methylpentanoic acid Traditional Name: 2-(2,3-dihydro-p-dioxin-5-carbonylamino)-3-methyl-valeric acid Formula: C11H17NO5 MolecularWeight: 243.25638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)C1=COCCO1

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)C1=COCCO1

InChI

InChI=1S/C11H17NO5/c1-3-7(2)9(11(14)15)12-10(13)8-6-16-4-5-17-8/h6-7,9H,3-5H2,1-2H3,(H,12,13)(H,14,15)