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

Systemtic Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) N-phenyl-N-(thiophen-3-ylmethyl)carbamate Openeye Name: (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) N-phenyl-N-(3-thienylmethyl)carbamate CAS Name: N-phenyl-N-(3-thiophenylmethyl)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-phenyl-N-(thiophen-3-ylmethyl)carbamate Traditional Name: N-phenyl-N-(3-thenyl)carbamic acid (8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester Formula: C21H27N2O2S+ MolecularWeight: 371.51628

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CCC1CC(C2)OC(=O)N(CC3=CSC=C3)C4=CC=CC=C4)C

Isomeric SMILES

C[N+]1(C2CCC1CC(C2)OC(=O)N(CC3=CSC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H27N2O2S/c1-23(2)18-8-9-19(23)13-20(12-18)25-21(24)22(14-16-10-11-26-15-16)17-6-4-3-5-7-17/h3-7,10-11,15,18-20H,8-9,12-14H2,1-2H3/q+1