1-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]pyrrolidin-1-ium

Systemtic Name: 1-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]pyrrolidin-1-ium Openeye Name: 1-[3-(2-tert-butyl-4-chloro-phenoxy)propyl]pyrrolidin-1-ium CAS Name: 1-[3-(2-tert-butyl-4-chlorophenoxy)propyl]pyrrolidin-1-ium IUPAC Name: 1-[3-(2-tert-butyl-4-chlorophenoxy)propyl]pyrrolidin-1-ium Traditional Name: 1-[3-(2-tert-butyl-4-chloro-phenoxy)propyl]pyrrolidin-1-ium Formula: C17H27ClNO+ MolecularWeight: 296.85538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCC[NH+]2CCCC2

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Cl)OCCC[NH+]2CCCC2

InChI

InChI=1S/C17H26ClNO/c1-17(2,3)15-13-14(18)7-8-16(15)20-12-6-11-19-9-4-5-10-19/h7-8,13H,4-6,9-12H2,1-3H3/p+1