2-[(4S)-2,2-dimethyl-4-phenyl-oxan-4-yl]ethyl-[(4-hydroxyphenyl)methyl]azanium

Systemtic Name: 2-[(4S)-2,2-dimethyl-4-phenyl-oxan-4-yl]ethyl-[(4-hydroxyphenyl)methyl]azanium Openeye Name: 2-[(4S)-2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl]ethyl-[(4-hydroxyphenyl)methyl]ammonium CAS Name: 2-[(4S)-2,2-dimethyl-4-phenyl-4-oxanyl]ethyl-[(4-hydroxyphenyl)methyl]ammonium IUPAC Name: 2-[(4S)-2,2-dimethyl-4-phenyloxan-4-yl]ethyl-[(4-hydroxyphenyl)methyl]azanium Traditional Name: 2-[(4S)-2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl]ethyl-(4-hydroxybenzyl)ammonium Formula: C22H30NO2+ MolecularWeight: 340.4791

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(CC[NH2+]CC2=CC=C(C=C2)O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C[C@@](CCO1)(CC[NH2+]CC2=CC=C(C=C2)O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H29NO2/c1-21(2)17-22(13-15-25-21,19-6-4-3-5-7-19)12-14-23-16-18-8-10-20(24)11-9-18/h3-11,23-24H,12-17H2,1-2H3/p+1/t22-/m0/s1