[4-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[4-(4-methyl-1-piperazin-4-iumyl)anilino]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-3-nitro-phenyl]-phenyl-methanone Formula: C24H25N4O3+ MolecularWeight: 417.4803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N4O3/c1-26-13-15-27(16-14-26)21-10-8-20(9-11-21)25-22-12-7-19(17-23(22)28(30)31)24(29)18-5-3-2-4-6-18/h2-12,17,25H,13-16H2,1H3/p+1