[7-acetyloxy-6-[(8-methyl-3-oxidanyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]naphthalen-1-yl] ethanoate

Systemtic Name: [7-acetyloxy-6-[(8-methyl-3-oxidanyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]naphthalen-1-yl] ethanoate Openeye Name: [7-acetoxy-6-[(3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]-1-naphthyl] acetate CAS Name: acetic acid [7-acetyloxy-6-[(3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]-1-naphthalenyl] ester IUPAC Name: [7-acetyloxy-6-[(3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]naphthalen-1-yl] acetate Traditional Name: acetic acid [7-acetoxy-6-[(3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]-1-naphthyl] ester Formula: C23H28NO5+ MolecularWeight: 398.47212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC2=CC(=C(C=C21)OC(=O)C)C[N+]3(C4CCC3CC(C4)O)C

Isomeric SMILES

CC(=O)OC1=CC=CC2=CC(=C(C=C21)OC(=O)C)C[N+]3(C4CCC3CC(C4)O)C

InChI

InChI=1S/C23H28NO5/c1-14(25)28-22-6-4-5-16-9-17(23(12-21(16)22)29-15(2)26)13-24(3)18-7-8-19(24)11-20(27)10-18/h4-6,9,12,18-20,27H,7-8,10-11,13H2,1-3H3/q+1