3-[5-chloranyl-2-(methylamino)phenyl]-2-(2-diethylaminoethyl)-3H-isoindol-1-one

Systemtic Name: 3-[5-chloranyl-2-(methylamino)phenyl]-2-(2-diethylaminoethyl)-3H-isoindol-1-one Openeye Name: 3-[5-chloro-2-(methylamino)phenyl]-2-(2-diethylaminoethyl)isoindolin-1-one CAS Name: 3-[5-chloro-2-(methylamino)phenyl]-2-(2-diethylaminoethyl)-3H-isoindol-1-one IUPAC Name: 3-[5-chloro-2-(methylamino)phenyl]-2-(2-diethylaminoethyl)-3H-isoindol-1-one Traditional Name: 3-[5-chloro-2-(methylamino)phenyl]-2-(2-diethylaminoethyl)isoindolin-1-one Formula: C21H26ClN3O MolecularWeight: 371.90364

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=C(C=CC(=C3)Cl)NC

Isomeric SMILES

CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=C(C=CC(=C3)Cl)NC

InChI

InChI=1S/C21H26ClN3O/c1-4-24(5-2)12-13-25-20(16-8-6-7-9-17(16)21(25)26)18-14-15(22)10-11-19(18)23-3/h6-11,14,20,23H,4-5,12-13H2,1-3H3