2-[3-chloranyl-4-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]isoindole-1,3-dione

Systemtic Name: 2-[3-chloranyl-4-[(5-methoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]isoindole-1,3-dione Openeye Name: 2-[3-chloro-4-[(5-methoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]isoindoline-1,3-dione CAS Name: 2-[3-chloro-4-[(5-methoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]isoindole-1,3-dione IUPAC Name: 2-[3-chloro-4-[(5-methoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]isoindole-1,3-dione Traditional Name: 2-[3-chloro-4-[(6-keto-5-methoxy-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]isoindoline-1,3-quinone Formula: C22H14ClN3O6 MolecularWeight: 451.81606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNC2=C(C=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)Cl)C1=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=CNC2=C(C=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)Cl)C1=O)[N+](=O)[O-]

InChI

InChI=1S/C22H14ClN3O6/c1-32-19-10-14(26(30)31)8-12(20(19)27)11-24-18-7-6-13(9-17(18)23)25-21(28)15-4-2-3-5-16(15)22(25)29/h2-11,24H,1H3