2-[4-[2-(dimethylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[2-(dimethylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[[2-(dimethylamino)-5-nitrophenyl]-oxomethyl]-1-piperazinyl]-N-phenylacetamide IUPAC Name: 2-[4-[2-(dimethylamino)-5-nitrobenzoyl]piperazin-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazino]-N-phenyl-acetamide Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25N5O4/c1-23(2)19-9-8-17(26(29)30)14-18(19)21(28)25-12-10-24(11-13-25)15-20(27)22-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3,(H,22,27)