N-[(E)-3H-indol-3-ylmethylideneamino]-3,5-dinitro-benzamide

Systemtic Name: N-[(E)-3H-indol-3-ylmethylideneamino]-3,5-dinitro-benzamide Openeye Name: N-[(E)-3H-indol-3-ylmethyleneamino]-3,5-dinitro-benzamide CAS Name: N-[(E)-3H-indol-3-ylmethylideneamino]-3,5-dinitrobenzamide IUPAC Name: N-[(E)-3H-indol-3-ylmethylideneamino]-3,5-dinitrobenzamide Traditional Name: N-[(E)-3H-indol-3-ylmethyleneamino]-3,5-dinitro-benzamide Formula: C16H11N5O5 MolecularWeight: 353.28904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C=N2)C=NNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C=N2)/C=N/NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11N5O5/c22-16(10-5-12(20(23)24)7-13(6-10)21(25)26)19-18-9-11-8-17-15-4-2-1-3-14(11)15/h1-9,11H,(H,19,22)/b18-9+