sodium 4-[[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]amino]phenolate hydrate

Systemtic Name: sodium 4-[[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]amino]phenolate hydrate Openeye Name: sodium 4-[(3,5-dichloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino]phenolate hydrate CAS Name: sodium 4-[(3,5-dichloro-4-oxo-1-cyclohexa-2,5-dienylidene)amino]phenolate hydrate IUPAC Name: sodium 4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate hydrate Traditional Name: sodium 4-[(3,5-dichloro-4-keto-cyclohexa-2,5-dien-1-ylidene)amino]phenolate hydrate Formula: C12H8Cl2NNaO3 MolecularWeight: 308.09259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=C2C=C(C(=O)C(=C2)Cl)Cl)[O-].O.[Na+]

Isomeric SMILES

C1=CC(=CC=C1N=C2C=C(C(=O)C(=C2)Cl)Cl)[O-].O.[Na+]

InChI

InChI=1S/C12H7Cl2NO2.Na.H2O/c13-10-5-8(6-11(14)12(10)17)15-7-1-3-9(16)4-2-7;;/h1-6,16H;;1H2/q;+1;/p-1