(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) N-(5-methyl-2-thiophen-2-yl-phenyl)carbamate

Systemtic Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) N-(5-methyl-2-thiophen-2-yl-phenyl)carbamate Openeye Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) N-[5-methyl-2-(2-thienyl)phenyl]carbamate CAS Name: N-(5-methyl-2-thiophen-2-ylphenyl)carbamic acid (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) N-(5-methyl-2-thiophen-2-ylphenyl)carbamate Traditional Name: N-[5-methyl-2-(2-thienyl)phenyl]carbamic acid (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester Formula: C21H27N2O2S+ MolecularWeight: 371.51628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=CS2)NC(=O)OC3CC4CCC(C3)[N+]4(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=CS2)NC(=O)OC3CC4CCC(C3)[N+]4(C)C

InChI

InChI=1S/C21H26N2O2S/c1-14-6-9-18(20-5-4-10-26-20)19(11-14)22-21(24)25-17-12-15-7-8-16(13-17)23(15,2)3/h4-6,9-11,15-17H,7-8,12-13H2,1-3H3/p+1