[3,5-dimethyl-4-(2-methylpropoxy)phenyl]methylazanium

Systemtic Name: [3,5-dimethyl-4-(2-methylpropoxy)phenyl]methylazanium Openeye Name: (4-isobutoxy-3,5-dimethyl-phenyl)methylammonium CAS Name: [3,5-dimethyl-4-(2-methylpropoxy)phenyl]methylammonium IUPAC Name: [3,5-dimethyl-4-(2-methylpropoxy)phenyl]methylazanium Traditional Name: (4-isobutoxy-3,5-dimethyl-benzyl)ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(C)C)C)C[NH3+]

Isomeric SMILES

CC1=CC(=CC(=C1OCC(C)C)C)C[NH3+]

InChI

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