3-(2-methyl-5-propan-2-yl-phenoxy)propylazanium

Systemtic Name: 3-(2-methyl-5-propan-2-yl-phenoxy)propylazanium Openeye Name: 3-(5-isopropyl-2-methyl-phenoxy)propylammonium CAS Name: 3-(2-methyl-5-propan-2-ylphenoxy)propylammonium IUPAC Name: 3-(2-methyl-5-propan-2-ylphenoxy)propylazanium Traditional Name: 3-(5-isopropyl-2-methyl-phenoxy)propylammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)OCCC[NH3+]

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)OCCC[NH3+]

InChI

InChI=1S/C13H21NO/c1-10(2)12-6-5-11(3)13(9-12)15-8-4-7-14/h5-6,9-10H,4,7-8,14H2,1-3H3/p+1