(1-ethylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate; sulfuric acid

Systemtic Name: (1-ethylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate; sulfuric acid Openeye Name: (1-ethylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate; sulfuric acid CAS Name: sulfuric acid; 9H-xanthene-9-carboxylic acid (1-ethyl-3-pyrrolidinyl) ester IUPAC Name: (1-ethylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate; sulfuric acid Traditional Name: sulfuric acid; 9H-xanthene-9-carboxylic acid (1-ethylpyrrolidin-3-yl) ester Formula: C20H23NO7S MolecularWeight: 421.46412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(C1)OC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24.OS(=O)(=O)O

Isomeric SMILES

CCN1CCC(C1)OC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24.OS(=O)(=O)O

InChI

InChI=1S/C20H21NO3.H2O4S/c1-2-21-12-11-14(13-21)23-20(22)19-15-7-3-5-9-17(15)24-18-10-6-4-8-16(18)19;1-5(2,3)4/h3-10,14,19H,2,11-13H2,1H3;(H2,1,2,3,4)