2-(4-chloranylphenoxy)-1-[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]ethanone

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]ethanone Openeye Name: 2-(4-chlorophenoxy)-1-[4-(4-phenylpiperazin-1-ium-1-yl)-1-piperidyl]ethanone CAS Name: 2-(4-chlorophenoxy)-1-[4-(4-phenyl-1-piperazin-1-iumyl)-1-piperidinyl]ethanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]ethanone Traditional Name: 2-(4-chlorophenoxy)-1-[4-(4-phenylpiperazin-1-ium-1-yl)piperidino]ethanone Formula: C23H29ClN3O2+ MolecularWeight: 414.94826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H28ClN3O2/c24-19-6-8-22(9-7-19)29-18-23(28)27-12-10-21(11-13-27)26-16-14-25(15-17-26)20-4-2-1-3-5-20/h1-9,21H,10-18H2/p+1