(4-ethylpiperazin-1-yl)-(3-nitrophenyl)methanone chloride

Systemtic Name: (4-ethylpiperazin-1-yl)-(3-nitrophenyl)methanone chloride Openeye Name: (4-ethylpiperazin-1-yl)-(3-nitrophenyl)methanone chloride CAS Name: (4-ethyl-1-piperazinyl)-(3-nitrophenyl)methanone chloride IUPAC Name: (4-ethylpiperazin-1-yl)-(3-nitrophenyl)methanone chloride Traditional Name: (4-ethylpiperazino)-(3-nitrophenyl)methanone chloride Formula: C13H17ClN3O3- MolecularWeight: 298.74538

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C13H17N3O3.ClH/c1-2-14-6-8-15(9-7-14)13(17)11-4-3-5-12(10-11)16(18)19;/h3-5,10H,2,6-9H2,1H3;1H/p-1