4-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-3-nitro-benzamide Openeye Name: 4-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-3-nitro-benzamide CAS Name: 4-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-3-nitrobenzamide IUPAC Name: 4-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-3-nitrobenzamide Traditional Name: 4-[4-(4-chloro-2-nitro-phenyl)piperazino]-3-nitro-benzamide Formula: C17H16ClN5O5 MolecularWeight: 405.79244

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN5O5/c18-12-2-4-14(16(10-12)23(27)28)21-7-5-20(6-8-21)13-3-1-11(17(19)24)9-15(13)22(25)26/h1-4,9-10H,5-8H2,(H2,19,24)