4-chloranyl-2-[[(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate

Systemtic Name: 4-chloranyl-2-[[(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate Openeye Name: 4-chloro-2-[[(5-ethoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate CAS Name: 4-chloro-2-[[(5-ethoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-oxomethyl]phenolate IUPAC Name: 4-chloro-2-[[(5-ethoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate Traditional Name: 4-chloro-2-[[(5-ethoxy-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]carbamoyl]phenolate Formula: C16H13ClN3O6- MolecularWeight: 378.74392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=CNNC(=O)C2=C(C=CC(=C2)Cl)[O-])C1=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=CNNC(=O)C2=C(C=CC(=C2)Cl)[O-])C1=O)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O6/c1-2-26-14-7-11(20(24)25)5-9(15(14)22)8-18-19-16(23)12-6-10(17)3-4-13(12)21/h3-8,18,21H,2H2,1H3,(H,19,23)/p-1