4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-(4-phenyldiazenylphenyl)benzamide

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-(4-phenyldiazenylphenyl)benzamide Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-(4-phenylazophenyl)benzamide CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-3-nitro-N-(4-phenyldiazenylphenyl)benzamide IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-(4-phenyldiazenylphenyl)benzamide Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-N-(4-phenylazophenyl)benzamide Formula: C24H25N6O3+ MolecularWeight: 445.4937

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H24N6O3/c1-28-13-15-29(16-14-28)22-12-7-18(17-23(22)30(32)33)24(31)25-19-8-10-21(11-9-19)27-26-20-5-3-2-4-6-20/h2-12,17H,13-16H2,1H3,(H,25,31)/p+1