2-(heptylcarbamoylamino)-3-methyl-butanoic acid

Systemtic Name: 2-(heptylcarbamoylamino)-3-methyl-butanoic acid Openeye Name: 2-(heptylcarbamoylamino)-3-methyl-butanoic acid CAS Name: 2-[[(heptylamino)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-(heptylcarbamoylamino)-3-methylbutanoic acid Traditional Name: 2-(heptylcarbamoylamino)-3-methyl-butyric acid Formula: C13H26N2O3 MolecularWeight: 258.35714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCCCCCCNC(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C13H26N2O3/c1-4-5-6-7-8-9-14-13(18)15-11(10(2)3)12(16)17/h10-11H,4-9H2,1-3H3,(H,16,17)(H2,14,15,18)