2-oxidanylidene-N-(2-phenylphenyl)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octane-4-carboxamide bromide

Systemtic Name: 2-oxidanylidene-N-(2-phenylphenyl)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octane-4-carboxamide bromide Openeye Name: 1-allyl-2-oxo-N-(2-phenylphenyl)quinuclidin-1-ium-4-carboxamide bromide CAS Name: 2-oxo-N-(2-phenylphenyl)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octane-4-carboxamide bromide IUPAC Name: 2-oxo-N-(2-phenylphenyl)-1-prop-2-enyl-1-azoniabicyclo[2.2.2]octane-4-carboxamide bromide Traditional Name: 1-allyl-2-keto-N-(2-phenylphenyl)quinuclidin-1-ium-4-carboxamide bromide Formula: C23H25BrN2O2 MolecularWeight: 441.3608

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]12CCC(CC1)(CC2=O)C(=O)NC3=CC=CC=C3C4=CC=CC=C4.[Br-]

Isomeric SMILES

C=CC[N+]12CCC(CC1)(CC2=O)C(=O)NC3=CC=CC=C3C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C23H24N2O2.BrH/c1-2-14-25-15-12-23(13-16-25,17-21(25)26)22(27)24-20-11-7-6-10-19(20)18-8-4-3-5-9-18;/h2-11H,1,12-17H2;1H