2-(2-diethylaminoethyloxy)ethyl 2-phenylbutanoate; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 2-(2-diethylaminoethyloxy)ethyl 2-phenylbutanoate; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 2-(2-diethylaminoethyloxy)ethyl 2-phenylbutanoate citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; 2-phenylbutanoic acid 2-(2-diethylaminoethyloxy)ethyl ester IUPAC Name: 2-(2-diethylaminoethyloxy)ethyl 2-phenylbutanoate; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 2-phenylbutyric acid 2-(2-diethylaminoethyloxy)ethyl ester citrate Formula: C24H34NO10-3 MolecularWeight: 496.52746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCCOCCN(CC)CC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OCCOCCN(CC)CC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

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