1-[2,5-bis(chloranyl)phenoxy]-1-methyl-4-(4-thiophen-2-ylbutyl)piperazin-1-ium

Systemtic Name: 1-[2,5-bis(chloranyl)phenoxy]-1-methyl-4-(4-thiophen-2-ylbutyl)piperazin-1-ium Openeye Name: 1-(2,5-dichlorophenoxy)-1-methyl-4-[4-(2-thienyl)butyl]piperazin-1-ium CAS Name: 1-(2,5-dichlorophenoxy)-1-methyl-4-(4-thiophen-2-ylbutyl)piperazin-1-ium IUPAC Name: 1-(2,5-dichlorophenoxy)-1-methyl-4-(4-thiophen-2-ylbutyl)piperazin-1-ium Traditional Name: 1-(2,5-dichlorophenoxy)-1-methyl-4-[4-(2-thienyl)butyl]piperazin-1-ium Formula: C19H25Cl2N2OS+ MolecularWeight: 400.3856

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)CCCCC2=CC=CS2)OC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

C[N+]1(CCN(CC1)CCCCC2=CC=CS2)OC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C19H25Cl2N2OS/c1-23(24-19-15-16(20)7-8-18(19)21)12-10-22(11-13-23)9-3-2-5-17-6-4-14-25-17/h4,6-8,14-15H,2-3,5,9-13H2,1H3/q+1