2,5-bis(chloranyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide

Systemtic Name: 2,5-bis(chloranyl)-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide Openeye Name: 2,5-dichloro-N-(3-nitro-4-piperazin-1-yl-phenyl)benzamide CAS Name: 2,5-dichloro-N-[3-nitro-4-(1-piperazinyl)phenyl]benzamide IUPAC Name: 2,5-dichloro-N-(3-nitro-4-piperazin-1-ylphenyl)benzamide Traditional Name: 2,5-dichloro-N-(3-nitro-4-piperazino-phenyl)benzamide Formula: C17H16Cl2N4O3 MolecularWeight: 395.23994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16Cl2N4O3/c18-11-1-3-14(19)13(9-11)17(24)21-12-2-4-15(16(10-12)23(25)26)22-7-5-20-6-8-22/h1-4,9-10,20H,5-8H2,(H,21,24)