2-[(2S,4S)-2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: 2-[(2S,4S)-2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: 2-[(2S,4S)-2-ethyl-2-methyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: 2-[(2S,4S)-2-ethyl-2-methyl-4-(4-methylphenyl)-4-oxanyl]ethyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: 2-[(2S,4S)-2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: 2-[(2S,4S)-2-ethyl-2-methyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl-p-anisyl-ammonium Formula: C25H36NO2+ MolecularWeight: 382.55884

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)(CC[NH2+]CC2=CC=C(C=C2)OC)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC[C@]1(C[C@@](CCO1)(CC[NH2+]CC2=CC=C(C=C2)OC)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C25H35NO2/c1-5-24(3)19-25(15-17-28-24,22-10-6-20(2)7-11-22)14-16-26-18-21-8-12-23(27-4)13-9-21/h6-13,26H,5,14-19H2,1-4H3/p+1/t24-,25-/m0/s1