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

Systemtic Name: 2-[(2R,4S)-2-ethyl-2-methyl-4-propan-2-yl-oxan-4-yl]ethyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: 2-[(2R,4S)-2-ethyl-4-isopropyl-2-methyl-tetrahydropyran-4-yl]ethyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: 2-[(2R,4S)-2-ethyl-2-methyl-4-propan-2-yl-4-oxanyl]ethyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: 2-[(2R,4S)-2-ethyl-2-methyl-4-propan-2-yloxan-4-yl]ethyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: 2-[(2R,4S)-2-ethyl-4-isopropyl-2-methyl-tetrahydropyran-4-yl]ethyl-p-anisyl-ammonium Formula: C21H36NO2+ MolecularWeight: 334.51604

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H35NO2/c1-6-20(4)16-21(17(2)3,12-14-24-20)11-13-22-15-18-7-9-19(23-5)10-8-18/h7-10,17,22H,6,11-16H2,1-5H3/p+1/t20-,21+/m1/s1