(6E)-6-(5,7-ditert-butyl-3H-1,3-benzoxazol-2-ylidene)-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(5,7-ditert-butyl-3H-1,3-benzoxazol-2-ylidene)-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-(5,7-ditert-butyl-3H-1,3-benzoxazol-2-ylidene)-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-(5,7-ditert-butyl-3H-1,3-benzoxazol-2-ylidene)-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(5,7-ditert-butyl-3H-1,3-benzoxazol-2-ylidene)-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-(5,7-ditert-butyl-3H-1,3-benzoxazol-2-ylidene)-2-nitro-cyclohexa-2,4-dien-1-one Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)NC(=C3C=CC=C(C3=O)[N+](=O)[O-])O2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)N/C(=C\3/C=CC=C(C3=O)[N+](=O)[O-])/O2)C(C)(C)C

InChI

InChI=1S/C21H24N2O4/c1-20(2,3)12-10-14(21(4,5)6)18-15(11-12)22-19(27-18)13-8-7-9-16(17(13)24)23(25)26/h7-11,22H,1-6H3/b19-13+