carboxymethyl-[2-[[(Z)-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]ethanoyl]azanide; nickel; trihydrate

Systemtic Name: carboxymethyl-[2-[[(Z)-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]ethanoyl]azanide; nickel; trihydrate Openeye Name: carboxymethyl-[2-[[(Z)-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]acetyl]azanide; nickel; trihydrate CAS Name: carboxymethyl-[2-[[(Z)-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]-1-oxoethyl]azanide; nickel; trihydrate IUPAC Name: carboxymethyl-[2-[[(Z)-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]acetyl]azanide; nickel; trihydrate Traditional Name: carboxymethyl-[2-[[(Z)-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]amino]acetyl]azanide; nickel; trihydrate Formula: C11H17N2NiO8- MolecularWeight: 363.95468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNCC(=O)[N-]CC(=O)O)C(=CC1=O)O.O.O.O.[Ni]

Isomeric SMILES

C1=C/C(=C/NCC(=O)[N-]CC(=O)O)/C(=CC1=O)O.O.O.O.[Ni]

InChI

InChI=1S/C11H12N2O5.Ni.3H2O/c14-8-2-1-7(9(15)3-8)4-12-5-10(16)13-6-11(17)18;;;;/h1-4H,5-6H2,(H4,12,13,14,15,16,17,18);;3*1H2/p-1