(phenylmethyl) N-methyl-N-[(2R,3R)-3-oxidanyl-1-pyrrolidin-1-ium-1-yl-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-methyl-N-[(2R,3R)-3-oxidanyl-1-pyrrolidin-1-ium-1-yl-butan-2-yl]carbamate Openeye Name: benzyl N-[(1R,2R)-2-hydroxy-1-(pyrrolidin-1-ium-1-ylmethyl)propyl]-N-methyl-carbamate CAS Name: N-[(2R,3R)-3-hydroxy-1-(1-pyrrolidin-1-iumyl)butan-2-yl]-N-methylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2R,3R)-3-hydroxy-1-pyrrolidin-1-ium-1-ylbutan-2-yl]-N-methylcarbamate Traditional Name: N-[(1R,2R)-2-hydroxy-1-(pyrrolidin-1-ium-1-ylmethyl)propyl]-N-methyl-carbamic acid benzyl ester Formula: C17H27N2O3+ MolecularWeight: 307.40788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C[NH+]1CCCC1)N(C)C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

C[C@H]([C@@H](C[NH+]1CCCC1)N(C)C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C17H26N2O3/c1-14(20)16(12-19-10-6-7-11-19)18(2)17(21)22-13-15-8-4-3-5-9-15/h3-5,8-9,14,16,20H,6-7,10-13H2,1-2H3/p+1/t14-,16-/m1/s1