4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]benzamide

Systemtic Name: 4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]benzamide Openeye Name: 4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methyleneamino]benzamide CAS Name: 4-nitro-N-[(E)-[5-nitro-2-(1-pyrrolidinyl)phenyl]methylideneamino]benzamide IUPAC Name: 4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-ylphenyl)methylideneamino]benzamide Traditional Name: 4-nitro-N-[(E)-(5-nitro-2-pyrrolidino-benzylidene)amino]benzamide Formula: C18H17N5O5 MolecularWeight: 383.35808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=N/NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O5/c24-18(13-3-5-15(6-4-13)22(25)26)20-19-12-14-11-16(23(27)28)7-8-17(14)21-9-1-2-10-21/h3-8,11-12H,1-2,9-10H2,(H,20,24)/b19-12+