[(3R)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octan-3-yl] N-(phenylmethyl)-N-thiophen-3-yl-carbamate

Systemtic Name: [(3R)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octan-3-yl] N-(phenylmethyl)-N-thiophen-3-yl-carbamate Openeye Name: [(3R)-1-allylquinuclidin-1-ium-3-yl] N-benzyl-N-(3-thienyl)carbamate CAS Name: N-(phenylmethyl)-N-(3-thiophenyl)carbamic acid [(3R)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3R)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octan-3-yl] N-benzyl-N-thiophen-3-ylcarbamate Traditional Name: N-benzyl-N-(3-thienyl)carbamic acid [(3R)-1-allylquinuclidin-1-ium-3-yl] ester Formula: C22H27N2O2S+ MolecularWeight: 383.52698

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]12CCC(CC1)C(C2)OC(=O)N(CC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C=CC[N+]12CCC(CC1)[C@H](C2)OC(=O)N(CC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C22H27N2O2S/c1-2-11-24-12-8-19(9-13-24)21(16-24)26-22(25)23(20-10-14-27-17-20)15-18-6-4-3-5-7-18/h2-7,10,14,17,19,21H,1,8-9,11-13,15-16H2/q+1/t19?,21-,24?/m0/s1