dicopper; sodium; 2,2-bis(2-hydroxyphenyl)ethanoate; ethane-1,2-diamine

Systemtic Name: dicopper; sodium; 2,2-bis(2-hydroxyphenyl)ethanoate; ethane-1,2-diamine Openeye Name: dicopper; sodium; 2,2-bis(2-hydroxyphenyl)acetate; ethane-1,2-diamine CAS Name: dicopper; sodium; 2,2-bis(2-hydroxyphenyl)acetate; ethane-1,2-diamine IUPAC Name: dicopper; sodium; 2,2-bis(2-hydroxyphenyl)acetate; ethane-1,2-diamine Traditional Name: dicupric; sodium; 2-aminoethylamine; 2,2-bis(2-hydroxyphenyl)acetate Formula: C72H63Cu2N2NaO20 MolecularWeight: 1426.35379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C(CN)N.[Na+].[Cu+2].[Cu+2]

Isomeric SMILES

C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C1=CC=C(C(=C1)C(C2=CC=CC=C2O)C(=O)[O-])O.C(CN)N.[Na+].[Cu+2].[Cu+2]

InChI

InChI=1S/5C14H12O4.C2H8N2.2Cu.Na/c5*15-11-7-3-1-5-9(11)13(14(17)18)10-6-2-4-8-12(10)16;3-1-2-4;;;/h5*1-8,13,15-16H,(H,17,18);1-4H2;;;/q;;;;;;2*+2;+1/p-5