2-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-ium-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone

Systemtic Name: 2-[4-(3,4-dichlorophenyl)carbonylpiperazin-1-ium-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Openeye Name: 2-[4-(3,4-dichlorobenzoyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methyl-1-piperidyl]ethanone CAS Name: 2-[4-[(3,4-dichlorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-1-[(2S)-2-methyl-1-piperidinyl]ethanone IUPAC Name: 2-[4-(3,4-dichlorobenzoyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Traditional Name: 2-[4-(3,4-dichlorobenzoyl)piperazin-1-ium-1-yl]-1-[(2S)-2-methylpiperidino]ethanone Formula: C19H26Cl2N3O2+ MolecularWeight: 399.33464

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H]1CCCCN1C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H25Cl2N3O2/c1-14-4-2-3-7-24(14)18(25)13-22-8-10-23(11-9-22)19(26)15-5-6-16(20)17(21)12-15/h5-6,12,14H,2-4,7-11,13H2,1H3/p+1/t14-/m0/s1