3-(3,5-dimethylpiperazin-1-yl)-1-(4-nitrophenyl)propan-1-one dihydrochloride

Systemtic Name: 3-(3,5-dimethylpiperazin-1-yl)-1-(4-nitrophenyl)propan-1-one dihydrochloride Openeye Name: 3-(3,5-dimethylpiperazin-1-yl)-1-(4-nitrophenyl)propan-1-one dihydrochloride CAS Name: 3-(3,5-dimethyl-1-piperazinyl)-1-(4-nitrophenyl)-1-propanone dihydrochloride IUPAC Name: 3-(3,5-dimethylpiperazin-1-yl)-1-(4-nitrophenyl)propan-1-one dihydrochloride Traditional Name: 3-(3,5-dimethylpiperazino)-1-(4-nitrophenyl)propan-1-one dihydrochloride Formula: C15H23Cl2N3O3 MolecularWeight: 364.26742

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)CCC(=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CC1CN(CC(N1)C)CCC(=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C15H21N3O3.2ClH/c1-11-9-17(10-12(2)16-11)8-7-15(19)13-3-5-14(6-4-13)18(20)21;;/h3-6,11-12,16H,7-10H2,1-2H3;2*1H