ethyl 5-chloranyl-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylate

Systemtic Name: ethyl 5-chloranyl-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylate Openeye Name: ethyl 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylate CAS Name: 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)-1-isoindolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylate Traditional Name: 5-chloro-3-(4-chlorophenyl)-2-(2-diethylaminoethyl)isoindole-1-carboxylic acid ethyl ester Formula: C23H26Cl2N2O2 MolecularWeight: 433.37074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26Cl2N2O2/c1-4-26(5-2)13-14-27-21(16-7-9-17(24)10-8-16)20-15-18(25)11-12-19(20)22(27)23(28)29-6-3/h7-12,15H,4-6,13-14H2,1-3H3