2-(4-tert-butylphenoxy)-N-[(E)-(3-nitro-4-pyrrolidin-1-yl-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(E)-(3-nitro-4-pyrrolidin-1-yl-phenyl)methylideneamino]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[(E)-(3-nitro-4-pyrrolidin-1-yl-phenyl)methyleneamino]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[(E)-[3-nitro-4-(1-pyrrolidinyl)phenyl]methylideneamino]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[(E)-(3-nitro-4-pyrrolidin-1-ylphenyl)methylideneamino]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(E)-(3-nitro-4-pyrrolidino-benzylidene)amino]acetamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N/N=C/C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O4/c1-23(2,3)18-7-9-19(10-8-18)31-16-22(28)25-24-15-17-6-11-20(21(14-17)27(29)30)26-12-4-5-13-26/h6-11,14-15H,4-5,12-13,16H2,1-3H3,(H,25,28)/b24-15+