(6Z)-6-[[(3,5-ditert-butyl-2-oxidanyl-phenyl)amino]methylidene]-3-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[[(3,5-ditert-butyl-2-oxidanyl-phenyl)amino]methylidene]-3-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[(3,5-ditert-butyl-2-hydroxy-anilino)methylene]-3-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[(3,5-ditert-butyl-2-hydroxyanilino)methylidene]-3-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[(3,5-ditert-butyl-2-hydroxyanilino)methylidene]-3-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[(3,5-ditert-butyl-2-hydroxy-anilino)methylene]-3-nitro-cyclohexa-2,4-dien-1-one Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)N/C=C\2/C=CC(=CC2=O)[N+](=O)[O-])O)C(C)(C)C

InChI

InChI=1S/C21H26N2O4/c1-20(2,3)14-9-16(21(4,5)6)19(25)17(10-14)22-12-13-7-8-15(23(26)27)11-18(13)24/h7-12,22,25H,1-6H3/b13-12-