zinc; N,N-dimethylcarbamodithioate; 7-oxidanylidene-1H-quinoline-2-carboxylic acid

Systemtic Name: zinc; N,N-dimethylcarbamodithioate; 7-oxidanylidene-1H-quinoline-2-carboxylic acid Openeye Name: zinc; N,N-dimethylcarbamodithioate; 7-oxo-1H-quinoline-2-carboxylic acid CAS Name: zinc; N,N-dimethylcarbamodithioate; 7-oxo-1H-quinoline-2-carboxylic acid IUPAC Name: zinc; N,N-dimethylcarbamodithioate; 7-oxo-1H-quinoline-2-carboxylic acid Traditional Name: zinc; N,N-dimethylcarbamodithioate; 7-keto-1H-quinoline-2-carboxylic acid Formula: C16H19N3O3S4Zn MolecularWeight: 495.00936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)[S-].CN(C)C(=S)[S-].C1=CC(=O)C=C2C1=CC=C(N2)C(=O)O.[Zn+2]

Isomeric SMILES

CN(C)C(=S)[S-].CN(C)C(=S)[S-].C1=CC(=O)C=C2C1=CC=C(N2)C(=O)O.[Zn+2]

InChI

InChI=1S/C10H7NO3.2C3H7NS2.Zn/c12-7-3-1-6-2-4-8(10(13)14)11-9(6)5-7;2*1-4(2)3(5)6;/h1-5,11H,(H,13,14);2*1-2H3,(H,5,6);/q;;;+2/p-2