4-[[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate

Systemtic Name: 4-[[(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate Openeye Name: 4-[[(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate CAS Name: 4-[[(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-oxomethyl]phenolate IUPAC Name: 4-[[(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate Traditional Name: 4-[[(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate Formula: C14H10N3O5- MolecularWeight: 300.2463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NNC=C2C=C(C=CC2=O)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NNC=C2C=C(C=CC2=O)[N+](=O)[O-])[O-]

InChI

InChI=1S/C14H11N3O5/c18-12-4-1-9(2-5-12)14(20)16-15-8-10-7-11(17(21)22)3-6-13(10)19/h1-8,15,18H,(H,16,20)/p-1