4-chloranyl-2-[[(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenolate

Systemtic Name: 4-chloranyl-2-[[(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenolate Openeye Name: 4-chloro-2-[[(3-methoxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenolate CAS Name: 4-chloro-2-[[(3-methoxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-oxomethyl]phenolate IUPAC Name: 4-chloro-2-[[(3-methoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenolate Traditional Name: 4-chloro-2-[[(4-keto-3-methoxy-5-nitro-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]phenolate Formula: C15H11ClN3O6- MolecularWeight: 364.71734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)C2=C(C=CC(=C2)Cl)[O-])C=C(C1=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CNNC(=O)C2=C(C=CC(=C2)Cl)[O-])C=C(C1=O)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClN3O6/c1-25-13-5-8(4-11(14(13)21)19(23)24)7-17-18-15(22)10-6-9(16)2-3-12(10)20/h2-7,17,20H,1H3,(H,18,22)/p-1