4-tert-butyl-2-[(Z)-(5,6-dimethoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-6-nitro-phenolate

Systemtic Name: 4-tert-butyl-2-[(Z)-(5,6-dimethoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-6-nitro-phenolate Openeye Name: 4-tert-butyl-2-[(Z)-(5,6-dimethoxy-2-oxo-indolin-3-ylidene)methyl]-6-nitro-phenolate CAS Name: 4-tert-butyl-2-[(Z)-(5,6-dimethoxy-2-oxo-1H-indol-3-ylidene)methyl]-6-nitrophenolate IUPAC Name: 4-tert-butyl-2-[(Z)-(5,6-dimethoxy-2-oxo-1H-indol-3-ylidene)methyl]-6-nitrophenolate Traditional Name: 4-tert-butyl-2-[(Z)-(2-keto-5,6-dimethoxy-indolin-3-ylidene)methyl]-6-nitro-phenolate Formula: C21H21N2O6- MolecularWeight: 397.40124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C=C2C3=CC(=C(C=C3NC2=O)OC)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)/C=C\2/C3=CC(=C(C=C3NC2=O)OC)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O6/c1-21(2,3)12-6-11(19(24)16(8-12)23(26)27)7-14-13-9-17(28-4)18(29-5)10-15(13)22-20(14)25/h6-10,24H,1-5H3,(H,22,25)/p-1/b14-7-