2-[(4R)-2,2-dimethyl-4-phenyl-oxan-4-yl]ethyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: 2-[(4R)-2,2-dimethyl-4-phenyl-oxan-4-yl]ethyl-(pyridin-3-ylmethyl)azanium Openeye Name: 2-[(4R)-2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl]ethyl-(3-pyridylmethyl)ammonium CAS Name: 2-[(4R)-2,2-dimethyl-4-phenyl-4-oxanyl]ethyl-(3-pyridinylmethyl)ammonium IUPAC Name: 2-[(4R)-2,2-dimethyl-4-phenyloxan-4-yl]ethyl-(pyridin-3-ylmethyl)azanium Traditional Name: 2-[(4R)-2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl]ethyl-(3-pyridylmethyl)ammonium Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O/c1-20(2)17-21(11-14-24-20,19-8-4-3-5-9-19)10-13-23-16-18-7-6-12-22-15-18/h3-9,12,15,23H,10-11,13-14,16-17H2,1-2H3/p+1/t21-/m1/s1