2-azanylpropanoyl 1-azanyl-2-(2-azanylpropanoyl)-2-methyl-cyclobutane-1-carboxylate; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 2-azanylpropanoyl 1-azanyl-2-(2-azanylpropanoyl)-2-methyl-cyclobutane-1-carboxylate; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 2-aminopropanoyl 1-amino-2-(2-aminopropanoyl)-2-methyl-cyclobutanecarboxylate citrate CAS Name: 1-amino-2-(2-amino-1-oxopropyl)-2-methyl-1-cyclobutanecarboxylic acid (2-amino-1-oxopropyl) ester; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 2-aminopropanoyl 1-amino-2-(2-aminopropanoyl)-2-methylcyclobutane-1-carboxylate; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 2-alanyl-1-amino-2-methyl-cyclobutanecarboxylic acid alanyl ester citrate Formula: C18H26N3O11-3 MolecularWeight: 460.41254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1(CCC1(C(=O)OC(=O)C(C)N)N)C)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CC(C(=O)C1(CCC1(C(=O)OC(=O)C(C)N)N)C)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C12H21N3O4.C6H8O7/c1-6(13)8(16)11(3)4-5-12(11,15)10(18)19-9(17)7(2)14;7-3(8)1-6(13,5(11)12)2-4(9)10/h6-7H,4-5,13-15H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3