2-azanyl-3-methyl-butanoic acid; 2-azanyl-4-methyl-pentanoic acid; methyl 2-azanyl-4-methyl-pentanoate

Systemtic Name: 2-azanyl-3-methyl-butanoic acid; 2-azanyl-4-methyl-pentanoic acid; methyl 2-azanyl-4-methyl-pentanoate Openeye Name: 2-amino-3-methyl-butanoic acid; 2-amino-4-methyl-pentanoic acid; methyl 2-amino-4-methyl-pentanoate CAS Name: 2-amino-3-methylbutanoic acid; 2-amino-4-methylpentanoic acid; 2-amino-4-methylpentanoic acid methyl ester IUPAC Name: 2-amino-3-methylbutanoic acid; 2-amino-4-methylpentanoic acid; methyl 2-amino-4-methylpentanoate Traditional Name: 2-amino-3-methyl-butyric acid; 2-amino-4-methyl-valeric acid; 2-amino-4-methyl-valeric acid methyl ester Formula: C18H39N3O6 MolecularWeight: 393.51876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H15NO2.C6H13NO2.C5H11NO2/c1-5(2)4-6(8)7(9)10-3;1-4(2)3-5(7)6(8)9;1-3(2)4(6)5(7)8/h5-6H,4,8H2,1-3H3;4-5H,3,7H2,1-2H3,(H,8,9);3-4H,6H2,1-2H3,(H,7,8)