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

Systemtic Name: 1-[3-(4-tert-butyl-2-methyl-phenoxy)propyl]pyrrolidin-1-ium Openeye Name: 1-[3-(4-tert-butyl-2-methyl-phenoxy)propyl]pyrrolidin-1-ium CAS Name: 1-[3-(4-tert-butyl-2-methylphenoxy)propyl]pyrrolidin-1-ium IUPAC Name: 1-[3-(4-tert-butyl-2-methylphenoxy)propyl]pyrrolidin-1-ium Traditional Name: 1-[3-(4-tert-butyl-2-methyl-phenoxy)propyl]pyrrolidin-1-ium Formula: C18H30NO+ MolecularWeight: 276.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OCCC[NH+]2CCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OCCC[NH+]2CCCC2

InChI

InChI=1S/C18H29NO/c1-15-14-16(18(2,3)4)8-9-17(15)20-13-7-12-19-10-5-6-11-19/h8-9,14H,5-7,10-13H2,1-4H3/p+1