2-[4-[2-(dimethylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[2-(dimethylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[2-(dimethylamino)-5-nitrophenyl]-oxomethyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[2-(dimethylamino)-5-nitrobenzoyl]piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[2-(dimethylamino)-5-nitro-benzoyl]piperazino]-1-piperidino-ethanone Formula: C20H29N5O4 MolecularWeight: 403.47536

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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)N3CCCCC3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC(=O)N3CCCCC3

InChI

InChI=1S/C20H29N5O4/c1-21(2)18-7-6-16(25(28)29)14-17(18)20(27)24-12-10-22(11-13-24)15-19(26)23-8-4-3-5-9-23/h6-7,14H,3-5,8-13,15H2,1-2H3