5-chloranyl-2-(2-diethylaminoethyl)-3-(2-fluorophenyl)isoindole-1-carboxylic acid

Systemtic Name: 5-chloranyl-2-(2-diethylaminoethyl)-3-(2-fluorophenyl)isoindole-1-carboxylic acid Openeye Name: 5-chloro-2-(2-diethylaminoethyl)-3-(2-fluorophenyl)isoindole-1-carboxylic acid CAS Name: 5-chloro-2-(2-diethylaminoethyl)-3-(2-fluorophenyl)-1-isoindolecarboxylic acid IUPAC Name: 5-chloro-2-(2-diethylaminoethyl)-3-(2-fluorophenyl)isoindole-1-carboxylic acid Traditional Name: 5-chloro-2-(2-diethylaminoethyl)-3-(2-fluorophenyl)isoindole-1-carboxylic acid Formula: C21H22ClFN2O2 MolecularWeight: 388.862983

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3F

Isomeric SMILES

CCN(CC)CCN1C(=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3F

InChI

InChI=1S/C21H22ClFN2O2/c1-3-24(4-2)11-12-25-19(16-7-5-6-8-18(16)23)17-13-14(22)9-10-15(17)20(25)21(26)27/h5-10,13H,3-4,11-12H2,1-2H3,(H,26,27)