1-[2-[(2S,4S)-4-phenyl-2-propan-2-yl-oxan-4-yl]ethyl]piperidin-1-ium

Systemtic Name: 1-[2-[(2S,4S)-4-phenyl-2-propan-2-yl-oxan-4-yl]ethyl]piperidin-1-ium Openeye Name: 1-[2-[(2S,4S)-2-isopropyl-4-phenyl-tetrahydropyran-4-yl]ethyl]piperidin-1-ium CAS Name: 1-[2-[(2S,4S)-4-phenyl-2-propan-2-yl-4-oxanyl]ethyl]piperidin-1-ium IUPAC Name: 1-[2-[(2S,4S)-4-phenyl-2-propan-2-yloxan-4-yl]ethyl]piperidin-1-ium Traditional Name: 1-[2-[(2S,4S)-2-isopropyl-4-phenyl-tetrahydropyran-4-yl]ethyl]piperidin-1-ium Formula: C21H34NO+ MolecularWeight: 316.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CC(CCO1)(CC[NH+]2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H]1C[C@@](CCO1)(CC[NH+]2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H33NO/c1-18(2)20-17-21(12-16-23-20,19-9-5-3-6-10-19)11-15-22-13-7-4-8-14-22/h3,5-6,9-10,18,20H,4,7-8,11-17H2,1-2H3/p+1/t20-,21-/m0/s1