1-(2-diethylaminoethyloxy)butan-2-yl 2-phenylethanoate; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 1-(2-diethylaminoethyloxy)butan-2-yl 2-phenylethanoate; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 1-(2-diethylaminoethyloxymethyl)propyl 2-phenylacetate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 2-phenylacetic acid 1-(2-diethylaminoethyloxy)butan-2-yl ester IUPAC Name: 1-(2-diethylaminoethyloxy)butan-2-yl 2-phenylacetate; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; 2-phenylacetic acid 1-(2-diethylaminoethyloxymethyl)propyl ester Formula: C24H37NO10 MolecularWeight: 499.55128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COCCN(CC)CC)OC(=O)CC1=CC=CC=C1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCC(COCCN(CC)CC)OC(=O)CC1=CC=CC=C1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C18H29NO3.C6H8O7/c1-4-17(15-21-13-12-19(5-2)6-3)22-18(20)14-16-10-8-7-9-11-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-11,17H,4-6,12-15H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)