[(3R,4R)-3-(3,5-dimethylphenoxy)-3,4-dihydro-2H-chromen-4-yl]azanium

Systemtic Name: [(3R,4R)-3-(3,5-dimethylphenoxy)-3,4-dihydro-2H-chromen-4-yl]azanium Openeye Name: [(3R,4R)-3-(3,5-dimethylphenoxy)chroman-4-yl]ammonium CAS Name: [(3R,4R)-3-(3,5-dimethylphenoxy)-3,4-dihydro-2H-1-benzopyran-4-yl]ammonium IUPAC Name: [(3R,4R)-3-(3,5-dimethylphenoxy)-3,4-dihydro-2H-chromen-4-yl]azanium Traditional Name: [(3R,4R)-3-(3,5-dimethylphenoxy)chroman-4-yl]ammonium Formula: C17H20NO2+ MolecularWeight: 270.3462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2COC3=CC=CC=C3C2[NH3+])C

Isomeric SMILES

CC1=CC(=CC(=C1)O[C@H]2COC3=CC=CC=C3[C@H]2[NH3+])C

InChI

InChI=1S/C17H19NO2/c1-11-7-12(2)9-13(8-11)20-16-10-19-15-6-4-3-5-14(15)17(16)18/h3-9,16-17H,10,18H2,1-2H3/p+1/t16-,17+/m0/s1