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

Systemtic Name: 2-[4-[2-(dimethylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[[2-(dimethylamino)-5-nitrophenyl]-oxomethyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[2-(dimethylamino)-5-nitrobenzoyl]piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazino]acetamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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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)NCC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H27N5O4/c1-24(2)20-9-8-18(27(30)31)14-19(20)22(29)26-12-10-25(11-13-26)16-21(28)23-15-17-6-4-3-5-7-17/h3-9,14H,10-13,15-16H2,1-2H3,(H,23,28)