2-(2-azanylpentanoylamino)-4-methyl-pentanoic acid; ethanoic acid

Systemtic Name: 2-(2-azanylpentanoylamino)-4-methyl-pentanoic acid; ethanoic acid Openeye Name: acetic acid; 2-(2-aminopentanoylamino)-4-methyl-pentanoic acid CAS Name: acetic acid; 2-[(2-amino-1-oxopentyl)amino]-4-methylpentanoic acid IUPAC Name: acetic acid; 2-(2-aminopentanoylamino)-4-methylpentanoic acid Traditional Name: acetic acid; 2-(2-aminopentanoylamino)-4-methyl-valeric acid Formula: C13H26N2O5 MolecularWeight: 290.35594

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(CC(C)C)C(=O)O)N.CC(=O)O

Isomeric SMILES

CCCC(C(=O)NC(CC(C)C)C(=O)O)N.CC(=O)O

InChI

InChI=1S/C11H22N2O3.C2H4O2/c1-4-5-8(12)10(14)13-9(11(15)16)6-7(2)3;1-2(3)4/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16);1H3,(H,3,4)