4-(2-azanyl-1-oxidanyl-ethyl)phenol; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 4-(2-azanyl-1-oxidanyl-ethyl)phenol; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: 4-(2-amino-1-hydroxy-ethyl)phenol; citric acid CAS Name: 4-(2-amino-1-hydroxyethyl)phenol; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 4-(2-amino-1-hydroxyethyl)phenol; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: 4-(2-amino-1-hydroxy-ethyl)phenol; citric acid Formula: C14H19NO9 MolecularWeight: 345.30196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CN)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1C(CN)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C8H11NO2.C6H8O7/c9-5-8(11)6-1-3-7(10)4-2-6;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-4,8,10-11H,5,9H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)