2-[2-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-thiazol-4-yl]-5-oxidanyl-phenolate

Systemtic Name: 2-[2-[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-thiazol-4-yl]-5-oxidanyl-phenolate Openeye Name: 5-hydroxy-2-[2-[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]thiazol-4-yl]phenolate CAS Name: 5-hydroxy-2-[2-[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-thiazolyl]phenolate IUPAC Name: 5-hydroxy-2-[2-[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-thiazol-4-yl]phenolate Traditional Name: 5-hydroxy-2-[2-[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]thiazol-4-yl]phenolate Formula: C16H10N3O5S- MolecularWeight: 356.3327

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CNC2=NC(=CS2)C3=C(C=C(C=C3)O)[O-])C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C(=CNC2=NC(=CS2)C3=C(C=C(C=C3)O)[O-])C=C1[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O5S/c20-11-2-3-12(15(22)6-11)13-8-25-16(18-13)17-7-9-5-10(19(23)24)1-4-14(9)21/h1-8,20,22H,(H,17,18)/p-1