1-[5-(4-tert-butyl-2-chloranyl-phenoxy)pentyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[5-(4-tert-butyl-2-chloranyl-phenoxy)pentyl]-4-methyl-piperidin-1-ium Openeye Name: 1-[5-(4-tert-butyl-2-chloro-phenoxy)pentyl]-4-methyl-piperidin-1-ium CAS Name: 1-[5-(4-tert-butyl-2-chlorophenoxy)pentyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[5-(4-tert-butyl-2-chlorophenoxy)pentyl]-4-methylpiperidin-1-ium Traditional Name: 1-[5-(4-tert-butyl-2-chloro-phenoxy)pentyl]-4-methyl-piperidin-1-ium Formula: C21H35ClNO+ MolecularWeight: 352.9617

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCCCOC2=C(C=C(C=C2)C(C)(C)C)Cl

Isomeric SMILES

CC1CC[NH+](CC1)CCCCCOC2=C(C=C(C=C2)C(C)(C)C)Cl

InChI

InChI=1S/C21H34ClNO/c1-17-10-13-23(14-11-17)12-6-5-7-15-24-20-9-8-18(16-19(20)22)21(2,3)4/h8-9,16-17H,5-7,10-15H2,1-4H3/p+1