[4-(cyclopropylamino)-3-nitro-phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-(cyclopropylamino)-3-nitrophenyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(cyclopropylamino)-3-nitrophenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C20H21N5O5 MolecularWeight: 411.41124

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5/c26-20(14-1-8-18(21-15-2-3-15)19(13-14)25(29)30)23-11-9-22(10-12-23)16-4-6-17(7-5-16)24(27)28/h1,4-8,13,15,21H,2-3,9-12H2