(phenylmethyl) N-[1-[(1R,2R)-1-oxidanyl-1-phenyl-propan-2-yl]piperidin-1-ium-4-yl]-N-phenyl-carbamate

Systemtic Name: (phenylmethyl) N-[1-[(1R,2R)-1-oxidanyl-1-phenyl-propan-2-yl]piperidin-1-ium-4-yl]-N-phenyl-carbamate Openeye Name: benzyl N-[1-[(1R,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]piperidin-1-ium-4-yl]-N-phenyl-carbamate CAS Name: N-[1-[(1R,2R)-1-hydroxy-1-phenylpropan-2-yl]-4-piperidin-1-iumyl]-N-phenylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[(1R,2R)-1-hydroxy-1-phenylpropan-2-yl]piperidin-1-ium-4-yl]-N-phenylcarbamate Traditional Name: N-[1-[(1R,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]piperidin-1-ium-4-yl]-N-phenyl-carbamic acid benzyl ester Formula: C28H33N2O3+ MolecularWeight: 445.57322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[NH+]2CCC(CC2)N(C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C[C@H]([C@@H](C1=CC=CC=C1)O)[NH+]2CCC(CC2)N(C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H32N2O3/c1-22(27(31)24-13-7-3-8-14-24)29-19-17-26(18-20-29)30(25-15-9-4-10-16-25)28(32)33-21-23-11-5-2-6-12-23/h2-16,22,26-27,31H,17-21H2,1H3/p+1/t22-,27+/m1/s1