4-bromanyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide

Systemtic Name: 4-bromanyl-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide Openeye Name: 4-bromo-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide CAS Name: 4-bromo-N-[3-nitro-4-(1-piperazinyl)phenyl]benzamide IUPAC Name: 4-bromo-N-(3-nitro-4-piperazin-1-ylphenyl)benzamide Traditional Name: 4-bromo-N-(3-nitro-4-piperazino-phenyl)benzamide Formula: C17H17BrN4O3 MolecularWeight: 405.24588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H17BrN4O3/c18-13-3-1-12(2-4-13)17(23)20-14-5-6-15(16(11-14)22(24)25)21-9-7-19-8-10-21/h1-6,11,19H,7-10H2,(H,20,23)