(1,1-dimethylpyrrolidin-1-ium-3-yl) 9H-xanthene-9-carboxylate

Systemtic Name: (1,1-dimethylpyrrolidin-1-ium-3-yl) 9H-xanthene-9-carboxylate Openeye Name: (1,1-dimethylpyrrolidin-1-ium-3-yl) 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid (1,1-dimethyl-3-pyrrolidin-1-iumyl) ester IUPAC Name: (1,1-dimethylpyrrolidin-1-ium-3-yl) 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid (1,1-dimethylpyrrolidin-1-ium-3-yl) ester Formula: C20H22NO3+ MolecularWeight: 324.39358

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(C1)OC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C

Isomeric SMILES

C[N+]1(CCC(C1)OC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C

InChI

InChI=1S/C20H22NO3/c1-21(2)12-11-14(13-21)23-20(22)19-15-7-3-5-9-17(15)24-18-10-6-4-8-16(18)19/h3-10,14,19H,11-13H2,1-2H3/q+1