2-oxidanylpropane-1,2,3-tricarboxylic acid; 4-phenyldiazenylbenzene-1,3-diamine; hydrochloride

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylic acid; 4-phenyldiazenylbenzene-1,3-diamine; hydrochloride Openeye Name: citric acid; 4-phenylazobenzene-1,3-diamine; hydrochloride CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 4-phenyldiazenylbenzene-1,3-diamine; hydrochloride IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid; 4-phenyldiazenylbenzene-1,3-diamine; hydrochloride Traditional Name: (3-amino-4-phenylazo-phenyl)amine; citric acid; hydrochloride Formula: C18H21ClN4O7 MolecularWeight: 440.83494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.Cl

InChI

InChI=1S/C12H12N4.C6H8O7.ClH/c13-9-6-7-12(11(14)8-9)16-15-10-4-2-1-3-5-10;7-3(8)1-6(13,5(11)12)2-4(9)10;/h1-8H,13-14H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H