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

Systemtic Name: 2-[(2S,4R)-2-ethyl-4-(2-methoxyphenyl)-2-methyl-oxan-4-yl]ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(2S,4R)-2-ethyl-4-(2-methoxyphenyl)-2-methyl-tetrahydropyran-4-yl]ethyl]ammonium CAS Name: 2-[(2S,4R)-2-ethyl-4-(2-methoxyphenyl)-2-methyl-4-oxanyl]ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(2S,4R)-2-ethyl-4-(2-methoxyphenyl)-2-methyloxan-4-yl]ethyl]azanium Traditional Name: benzyl-[2-[(2S,4R)-2-ethyl-4-(2-methoxyphenyl)-2-methyl-tetrahydropyran-4-yl]ethyl]ammonium Formula: C24H34NO2+ MolecularWeight: 368.53226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)(CC[NH2+]CC2=CC=CC=C2)C3=CC=CC=C3OC)C

Isomeric SMILES

CC[C@]1(C[C@](CCO1)(CC[NH2+]CC2=CC=CC=C2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C24H33NO2/c1-4-23(2)19-24(15-17-27-23,21-12-8-9-13-22(21)26-3)14-16-25-18-20-10-6-5-7-11-20/h5-13,25H,4,14-19H2,1-3H3/p+1/t23-,24+/m0/s1