4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-yl-phenol; ethanoic acid; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-yl-phenol; ethanoic acid; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: acetic acid; citric acid; 4-(2-dimethylaminoethyloxy)-5-isopropyl-2-methyl-phenol CAS Name: acetic acid; 4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-ylphenol; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: acetic acid; 4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-ylphenol; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: acetic acid; citric acid; 4-(2-dimethylaminoethyloxy)-5-isopropyl-2-methyl-phenol Formula: C22H35NO11 MolecularWeight: 489.5134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1O)C(C)C)OCCN(C)C.CC(=O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1O)C(C)C)OCCN(C)C.CC(=O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C14H23NO2.C6H8O7.C2H4O2/c1-10(2)12-9-13(16)11(3)8-14(12)17-7-6-15(4)5;7-3(8)1-6(13,5(11)12)2-4(9)10;1-2(3)4/h8-10,16H,6-7H2,1-5H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H3,(H,3,4)