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

Systemtic Name: 3-[5-chloranyl-2-(ethylamino)phenyl]-2-(2-diethylaminoethyl)-3H-isoindol-1-one Openeye Name: 3-[5-chloro-2-(ethylamino)phenyl]-2-(2-diethylaminoethyl)isoindolin-1-one CAS Name: 3-[5-chloro-2-(ethylamino)phenyl]-2-(2-diethylaminoethyl)-3H-isoindol-1-one IUPAC Name: 3-[5-chloro-2-(ethylamino)phenyl]-2-(2-diethylaminoethyl)-3H-isoindol-1-one Traditional Name: 3-[5-chloro-2-(ethylamino)phenyl]-2-(2-diethylaminoethyl)isoindolin-1-one Formula: C22H28ClN3O MolecularWeight: 385.93022

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)Cl)C2C3=CC=CC=C3C(=O)N2CCN(CC)CC

Isomeric SMILES

CCNC1=C(C=C(C=C1)Cl)C2C3=CC=CC=C3C(=O)N2CCN(CC)CC

InChI

InChI=1S/C22H28ClN3O/c1-4-24-20-12-11-16(23)15-19(20)21-17-9-7-8-10-18(17)22(27)26(21)14-13-25(5-2)6-3/h7-12,15,21,24H,4-6,13-14H2,1-3H3