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

Systemtic Name: 2-[(2R,4S)-2-ethyl-2-methyl-4-propan-2-yl-oxan-4-yl]ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(2R,4S)-2-ethyl-4-isopropyl-2-methyl-tetrahydropyran-4-yl]ethyl]ammonium CAS Name: 2-[(2R,4S)-2-ethyl-2-methyl-4-propan-2-yl-4-oxanyl]ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(2R,4S)-2-ethyl-2-methyl-4-propan-2-yloxan-4-yl]ethyl]azanium Traditional Name: benzyl-[2-[(2R,4S)-2-ethyl-4-isopropyl-2-methyl-tetrahydropyran-4-yl]ethyl]ammonium Formula: C20H34NO+ MolecularWeight: 304.49006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33NO/c1-5-19(4)16-20(17(2)3,12-14-22-19)11-13-21-15-18-9-7-6-8-10-18/h6-10,17,21H,5,11-16H2,1-4H3/p+1/t19-,20+/m1/s1