5-chloranyl-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid

Systemtic Name: 5-chloranyl-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid Openeye Name: 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid CAS Name: 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)-1-isoindolecarboxylic acid IUPAC Name: 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid Traditional Name: 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid Formula: C21H22Cl2N2O2 MolecularWeight: 405.31758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22Cl2N2O2/c1-3-24(4-2)11-12-25-19(14-5-7-15(22)8-6-14)18-13-16(23)9-10-17(18)20(25)21(26)27/h5-10,13H,3-4,11-12H2,1-2H3,(H,26,27)