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

Systemtic Name: [7-acetyloxy-6-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]naphthalen-1-yl] ethanoate Openeye Name: [7-acetoxy-6-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]-1-naphthyl] acetate CAS Name: acetic acid [7-acetyloxy-6-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]-1-naphthalenyl] ester IUPAC Name: [7-acetyloxy-6-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]naphthalen-1-yl] acetate Traditional Name: acetic acid [7-acetoxy-6-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]-1-naphthyl] ester Formula: C23H28NO4+ MolecularWeight: 382.47272

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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(C4CCCC3CC4)C

Isomeric SMILES

CC(=O)OC1=CC=CC2=CC(=C(C=C21)OC(=O)C)C[N+]3(C4CCCC3CC4)C

InChI

InChI=1S/C23H28NO4/c1-15(25)27-22-9-4-6-17-12-18(23(13-21(17)22)28-16(2)26)14-24(3)19-7-5-8-20(24)11-10-19/h4,6,9,12-13,19-20H,5,7-8,10-11,14H2,1-3H3/q+1