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O2-(2-diethylaminoethyl) O1-(2-methylpropyl) 4-azanylbenzene-1,2-dicarboxylate; 2-oxidanylpropane-1,2,3-tricarboxylic acid

O2-(2-diethylaminoethyl) O1-(2-methylpropyl) 4-azanylbenzene-1,2-dicarboxylate; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name:O2-(2-diethylaminoethyl) O1-(2-methylpropyl) 4-azanylbenzene-1,2-dicarboxylate; 2-oxidanylpropane-1,2,3-tricarboxylic acid
Openeye Name:citric acid; O2-(2-diethylaminoethyl) O1-isobutyl 4-aminobenzene-1,2-dicarboxylate
CAS Name:4-aminobenzene-1,2-dicarboxylic acid O2-(2-diethylaminoethyl) ester O1-(2-methylpropyl) ester; 2-hydroxypropane-1,2,3-tricarboxylic acid
IUPAC Name:2-O-(2-diethylaminoethyl) 1-O-(2-methylpropyl) 4-aminobenzene-1,2-dicarboxylate; 2-hydroxypropane-1,2,3-tricarboxylic acid
Traditional Name:4-aminobenzene-1,2-dicarboxylic acid O2-(2-diethylaminoethyl) ester O1-isobutyl ester; citric acid
Formula: C24H36N2O11
MolecularWeight: 528.54944
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=C(C=CC(=C1)N)C(=O)OCC(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O


Isomeric SMILES

CCN(CC)CCOC(=O)C1=C(C=CC(=C1)N)C(=O)OCC(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O


InChI

InChI=1S/C18H28N2O4.C6H8O7/c1-5-20(6-2)9-10-23-18(22)16-11-14(19)7-8-15(16)17(21)24-12-13(3)4;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-8,11,13H,5-6,9-10,12,19H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)


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