2-[(4R)-2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethyl-(phenylmethyl)azanium

Systemtic Name: 2-[(4R)-2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(4R)-2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl]ammonium CAS Name: 2-[(4R)-2,2-dimethyl-4-(4-methylphenyl)-4-oxanyl]ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(4R)-2,2-dimethyl-4-(4-methylphenyl)oxan-4-yl]ethyl]azanium Traditional Name: benzyl-[2-[(4R)-2,2-dimethyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl]ammonium Formula: C23H32NO+ MolecularWeight: 338.50628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCOC(C2)(C)C)CC[NH2+]CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)[C@@]2(CCOC(C2)(C)C)CC[NH2+]CC3=CC=CC=C3

InChI

InChI=1S/C23H31NO/c1-19-9-11-21(12-10-19)23(14-16-25-22(2,3)18-23)13-15-24-17-20-7-5-4-6-8-20/h4-12,24H,13-18H2,1-3H3/p+1/t23-/m1/s1