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

Systemtic Name: 3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid CAS Name: 3-(4-chlorophenyl)-2-(2-diethylaminoethyl)-1-isoindolecarboxylic acid IUPAC Name: 3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid Traditional Name: 3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid Formula: C21H23ClN2O2 MolecularWeight: 370.87252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN2O2/c1-3-23(4-2)13-14-24-19(15-9-11-16(22)12-10-15)17-7-5-6-8-18(17)20(24)21(25)26/h5-12H,3-4,13-14H2,1-2H3,(H,25,26)