1-[(4R)-4-[2-(diphenylmethyl)oxyethoxy]-4-methyl-hex-2-ynyl]piperidin-1-ium

Systemtic Name: 1-[(4R)-4-[2-(diphenylmethyl)oxyethoxy]-4-methyl-hex-2-ynyl]piperidin-1-ium Openeye Name: 1-[(4R)-4-(2-benzhydryloxyethoxy)-4-methyl-hex-2-ynyl]piperidin-1-ium CAS Name: 1-[(4R)-4-[2-(diphenylmethyl)oxyethoxy]-4-methylhex-2-ynyl]piperidin-1-ium IUPAC Name: 1-[(4R)-4-(2-benzhydryloxyethoxy)-4-methylhex-2-ynyl]piperidin-1-ium Traditional Name: 1-[(4R)-4-(2-benzhydryloxyethoxy)-4-methyl-hex-2-ynyl]piperidin-1-ium Formula: C27H36NO2+ MolecularWeight: 406.58024

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#CC[NH+]1CCCCC1)OCCOC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC[C@](C)(C#CC[NH+]1CCCCC1)OCCOC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H35NO2/c1-3-27(2,18-13-21-28-19-11-6-12-20-28)30-23-22-29-26(24-14-7-4-8-15-24)25-16-9-5-10-17-25/h4-5,7-10,14-17,26H,3,6,11-12,19-23H2,1-2H3/p+1/t27-/m1/s1