N-[(E)-1-(4-benzamidophenyl)ethylideneamino]-3,5-dinitro-benzamide

Systemtic Name: N-[(E)-1-(4-benzamidophenyl)ethylideneamino]-3,5-dinitro-benzamide Openeye Name: N-[(E)-1-(4-benzamidophenyl)ethylideneamino]-3,5-dinitro-benzamide CAS Name: N-[(E)-1-(4-benzamidophenyl)ethylideneamino]-3,5-dinitrobenzamide IUPAC Name: N-[(E)-1-(4-benzamidophenyl)ethylideneamino]-3,5-dinitrobenzamide Traditional Name: N-[(E)-1-(4-benzamidophenyl)ethylideneamino]-3,5-dinitro-benzamide Formula: C22H17N5O6 MolecularWeight: 447.40028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N5O6/c1-14(15-7-9-18(10-8-15)23-21(28)16-5-3-2-4-6-16)24-25-22(29)17-11-19(26(30)31)13-20(12-17)27(32)33/h2-13H,1H3,(H,23,28)(H,25,29)/b24-14+