2-[(2R,4S)-2-ethyl-4-(4-methoxyphenyl)-2-methyl-oxan-4-yl]ethylazanium

Systemtic Name: 2-[(2R,4S)-2-ethyl-4-(4-methoxyphenyl)-2-methyl-oxan-4-yl]ethylazanium Openeye Name: 2-[(2R,4S)-2-ethyl-4-(4-methoxyphenyl)-2-methyl-tetrahydropyran-4-yl]ethylammonium CAS Name: 2-[(2R,4S)-2-ethyl-4-(4-methoxyphenyl)-2-methyl-4-oxanyl]ethylammonium IUPAC Name: 2-[(2R,4S)-2-ethyl-4-(4-methoxyphenyl)-2-methyloxan-4-yl]ethylazanium Traditional Name: 2-[(2R,4S)-2-ethyl-4-(4-methoxyphenyl)-2-methyl-tetrahydropyran-4-yl]ethylammonium Formula: C17H28NO2+ MolecularWeight: 278.40972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)(CC[NH3+])C2=CC=C(C=C2)OC)C

Isomeric SMILES

CC[C@@]1(C[C@@](CCO1)(CC[NH3+])C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C17H27NO2/c1-4-16(2)13-17(9-11-18,10-12-20-16)14-5-7-15(19-3)8-6-14/h5-8H,4,9-13,18H2,1-3H3/p+1/t16-,17+/m1/s1