3-(1,5-diphenylpentoxy)-N,N-dimethyl-propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 3-(1,5-diphenylpentoxy)-N,N-dimethyl-propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 3-(1,5-diphenylpentoxy)-N,N-dimethyl-propan-1-amine CAS Name: 3-(1,5-diphenylpentoxy)-N,N-dimethyl-1-propanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 3-(1,5-diphenylpentoxy)-N,N-dimethylpropan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; 3-(1,5-diphenylpentoxy)propyl-dimethyl-amine Formula: C28H39NO8 MolecularWeight: 517.61116

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC(CCCCC1=CC=CC=C1)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CN(C)CCCOC(CCCCC1=CC=CC=C1)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C22H31NO.C6H8O7/c1-23(2)18-11-19-24-22(21-15-7-4-8-16-21)17-10-9-14-20-12-5-3-6-13-20;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-8,12-13,15-16,22H,9-11,14,17-19H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)