N-[2-(2-chloranylphenoxy)phenyl]-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-(2-chloranylphenoxy)phenyl]-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(2-chlorophenoxy)phenyl]-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide CAS Name: N-[2-(2-chlorophenoxy)phenyl]-4-(4-methyl-1-piperazin-4-iumyl)-3-nitrobenzamide IUPAC Name: N-[2-(2-chlorophenoxy)phenyl]-4-(4-methylpiperazin-4-ium-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(2-chlorophenoxy)phenyl]-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide Formula: C24H24ClN4O4+ MolecularWeight: 467.92476

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3OC4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3OC4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H23ClN4O4/c1-27-12-14-28(15-13-27)20-11-10-17(16-21(20)29(31)32)24(30)26-19-7-3-5-9-23(19)33-22-8-4-2-6-18(22)25/h2-11,16H,12-15H2,1H3,(H,26,30)/p+1