2-[(2S,4R)-2-ethyl-2-methyl-4-propan-2-yl-oxan-4-yl]ethyl-[(4-propan-2-yloxyphenyl)methyl]azanium

Systemtic Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-propan-2-yl-oxan-4-yl]ethyl-[(4-propan-2-yloxyphenyl)methyl]azanium Openeye Name: 2-[(2S,4R)-2-ethyl-4-isopropyl-2-methyl-tetrahydropyran-4-yl]ethyl-[(4-isopropoxyphenyl)methyl]ammonium CAS Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-propan-2-yl-4-oxanyl]ethyl-[(4-propan-2-yloxyphenyl)methyl]ammonium IUPAC Name: 2-[(2S,4R)-2-ethyl-2-methyl-4-propan-2-yloxan-4-yl]ethyl-[(4-propan-2-yloxyphenyl)methyl]azanium Traditional Name: 2-[(2S,4R)-2-ethyl-4-isopropyl-2-methyl-tetrahydropyran-4-yl]ethyl-(4-isopropoxybenzyl)ammonium Formula: C23H40NO2+ MolecularWeight: 362.5692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H39NO2/c1-7-22(6)17-23(18(2)3,13-15-25-22)12-14-24-16-20-8-10-21(11-9-20)26-19(4)5/h8-11,18-19,24H,7,12-17H2,1-6H3/p+1/t22-,23+/m0/s1