1-ethyl-1-pyrrolidin-3-yl-xanthene-9-carboxylic acid

Systemtic Name: 1-ethyl-1-pyrrolidin-3-yl-xanthene-9-carboxylic acid Openeye Name: 1-ethyl-1-pyrrolidin-3-yl-xanthene-9-carboxylic acid CAS Name: 1-ethyl-1-(3-pyrrolidinyl)-9-xanthenecarboxylic acid IUPAC Name: 1-ethyl-1-pyrrolidin-3-ylxanthene-9-carboxylic acid Traditional Name: 1-ethyl-1-pyrrolidin-3-yl-xanthene-9-carboxylic acid Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=CC=C2C1=C(C3=CC=CC=C3O2)C(=O)O)C4CCNC4

Isomeric SMILES

CCC1(C=CC=C2C1=C(C3=CC=CC=C3O2)C(=O)O)C4CCNC4

InChI

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