methyl-[3-(3-propan-2-ylphenoxy)propyl]azanium

Systemtic Name: methyl-[3-(3-propan-2-ylphenoxy)propyl]azanium Openeye Name: 3-(3-isopropylphenoxy)propyl-methyl-ammonium CAS Name: methyl-[3-(3-propan-2-ylphenoxy)propyl]ammonium IUPAC Name: methyl-[3-(3-propan-2-ylphenoxy)propyl]azanium Traditional Name: 3-(3-isopropylphenoxy)propyl-methyl-ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OCCC[NH2+]C

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OCCC[NH2+]C

InChI

InChI=1S/C13H21NO/c1-11(2)12-6-4-7-13(10-12)15-9-5-8-14-3/h4,6-7,10-11,14H,5,8-9H2,1-3H3/p+1