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

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

Systemtic Name:O2-(2-diethylaminoethyl) O1-propan-2-yl 3-azanylbenzene-1,2-dicarboxylate; 2-oxidanylpropane-1,2,3-tricarboxylic acid
Openeye Name:citric acid; O2-(2-diethylaminoethyl) O1-isopropyl 3-aminobenzene-1,2-dicarboxylate
CAS Name:3-aminobenzene-1,2-dicarboxylic acid O2-(2-diethylaminoethyl) ester O1-propan-2-yl ester; 2-hydroxypropane-1,2,3-tricarboxylic acid
IUPAC Name:2-O-(2-diethylaminoethyl) 1-O-propan-2-yl 3-aminobenzene-1,2-dicarboxylate; 2-hydroxypropane-1,2,3-tricarboxylic acid
Traditional Name:3-aminobenzene-1,2-dicarboxylic acid O2-(2-diethylaminoethyl) ester O1-isopropyl ester; citric acid
Formula: C23H34N2O11
MolecularWeight: 514.52286
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=C(C=CC=C1N)C(=O)OC(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O


Isomeric SMILES

CCN(CC)CCOC(=O)C1=C(C=CC=C1N)C(=O)OC(C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O


InChI

InChI=1S/C17H26N2O4.C6H8O7/c1-5-19(6-2)10-11-22-17(21)15-13(8-7-9-14(15)18)16(20)23-12(3)4;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-9,12H,5-6,10-11,18H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)


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