(4S,6S)-4-cyclohexyl-6-[(1R)-2,2-diphenylcyclopentyl]oxy-2-oxidanidyl-5,6-dihydro-4H-1,2-oxazin-2-ium

Systemtic Name: (4S,6S)-4-cyclohexyl-6-[(1R)-2,2-diphenylcyclopentyl]oxy-2-oxidanidyl-5,6-dihydro-4H-1,2-oxazin-2-ium Openeye Name: (4S,6S)-4-cyclohexyl-6-[(1R)-2,2-diphenylcyclopentoxy]-2-oxido-5,6-dihydro-4H-oxazin-2-ium CAS Name: (4S,6S)-4-cyclohexyl-6-[(1R)-2,2-diphenylcyclopentyl]oxy-2-oxido-5,6-dihydro-4H-oxazin-2-ium IUPAC Name: (4S,6S)-4-cyclohexyl-6-[(1R)-2,2-diphenylcyclopentyl]oxy-2-oxido-5,6-dihydro-4H-oxazin-2-ium Traditional Name: (4S,6S)-4-cyclohexyl-6-[(1R)-2,2-diphenylcyclopentoxy]-2-oxido-5,6-dihydro-4H-oxazin-2-ium Formula: C27H33NO3 MolecularWeight: 419.55582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(O[N+](=C2)[O-])OC3CCCC3(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)[C@@H]2C[C@H](O[N+](=C2)[O-])O[C@@H]3CCCC3(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H33NO3/c29-28-20-22(21-11-4-1-5-12-21)19-26(31-28)30-25-17-10-18-27(25,23-13-6-2-7-14-23)24-15-8-3-9-16-24/h2-3,6-9,13-16,20-22,25-26H,1,4-5,10-12,17-19H2/t22-,25-,26+/m1/s1