1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-morpholin-4-ium-4-yl-ethanone

Systemtic Name: 1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-2-morpholin-4-ium-4-yl-ethanone Openeye Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-2-morpholin-4-ium-4-yl-ethanone CAS Name: 1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-2-(4-morpholin-4-iumyl)ethanone IUPAC Name: 1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-2-morpholin-4-ium-4-ylethanone Traditional Name: 1-[4-(4-chloro-2-nitro-phenyl)piperazino]-2-morpholin-4-ium-4-yl-ethanone Formula: C16H22ClN4O4+ MolecularWeight: 369.82328

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H21ClN4O4/c17-13-1-2-14(15(11-13)21(23)24)19-3-5-20(6-4-19)16(22)12-18-7-9-25-10-8-18/h1-2,11H,3-10,12H2/p+1