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

Systemtic Name: 2-(2-diethylaminoethyl)-3-[2-(methylamino)phenyl]-3H-isoindol-1-one Openeye Name: 2-(2-diethylaminoethyl)-3-[2-(methylamino)phenyl]isoindolin-1-one CAS Name: 2-(2-diethylaminoethyl)-3-[2-(methylamino)phenyl]-3H-isoindol-1-one IUPAC Name: 2-(2-diethylaminoethyl)-3-[2-(methylamino)phenyl]-3H-isoindol-1-one Traditional Name: 2-(2-diethylaminoethyl)-3-[2-(methylamino)phenyl]isoindolin-1-one Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=CC=CC=C3NC

Isomeric SMILES

CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=CC=CC=C3NC

InChI

InChI=1S/C21H27N3O/c1-4-23(5-2)14-15-24-20(18-12-8-9-13-19(18)22-3)16-10-6-7-11-17(16)21(24)25/h6-13,20,22H,4-5,14-15H2,1-3H3