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2-azanyl-3-methyl-butanoic acid; 3-methyl-2-(undecylamino)butanoic acid

2-azanyl-3-methyl-butanoic acid; 3-methyl-2-(undecylamino)butanoic acid

Systemtic Name:2-azanyl-3-methyl-butanoic acid; 3-methyl-2-(undecylamino)butanoic acid
Openeye Name:2-amino-3-methyl-butanoic acid; 3-methyl-2-(undecylamino)butanoic acid
CAS Name:2-amino-3-methylbutanoic acid; 3-methyl-2-(undecylamino)butanoic acid
IUPAC Name:2-amino-3-methylbutanoic acid; 3-methyl-2-(undecylamino)butanoic acid
Traditional Name:2-amino-3-methyl-butyric acid; 3-methyl-2-(undecylamino)butyric acid
Formula: C21H44N2O4
MolecularWeight: 388.58506
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC(C(C)C)C(=O)O.CC(C)C(C(=O)O)N


Isomeric SMILES

CCCCCCCCCCCNC(C(C)C)C(=O)O.CC(C)C(C(=O)O)N


InChI

InChI=1S/C16H33NO2.C5H11NO2/c1-4-5-6-7-8-9-10-11-12-13-17-15(14(2)3)16(18)19;1-3(2)4(6)5(7)8/h14-15,17H,4-13H2,1-3H3,(H,18,19);3-4H,6H2,1-2H3,(H,7,8)


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