2-chloranyl-N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-5-nitro-benzamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]-2-chloro-5-nitro-benzamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-2-chloro-5-nitrobenzamide Traditional Name: N-[4-(4-acetylpiperazino)-3-chloro-phenyl]-2-chloro-5-nitro-benzamide Formula: C19H18Cl2N4O4 MolecularWeight: 437.27662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C19H18Cl2N4O4/c1-12(26)23-6-8-24(9-7-23)18-5-2-13(10-17(18)21)22-19(27)15-11-14(25(28)29)3-4-16(15)20/h2-5,10-11H,6-9H2,1H3,(H,22,27)