7-chloranyl-2-[(4-chlorophenyl)methyl]-5-[3-(4-methylpiperazin-1-yl)prop-1-ynyl]-3H-isoindol-1-one

Systemtic Name: 7-chloranyl-2-[(4-chlorophenyl)methyl]-5-[3-(4-methylpiperazin-1-yl)prop-1-ynyl]-3H-isoindol-1-one Openeye Name: 7-chloro-2-[(4-chlorophenyl)methyl]-5-[3-(4-methylpiperazin-1-yl)prop-1-ynyl]isoindolin-1-one CAS Name: 7-chloro-2-[(4-chlorophenyl)methyl]-5-[3-(4-methyl-1-piperazinyl)prop-1-ynyl]-3H-isoindol-1-one IUPAC Name: 7-chloro-2-[(4-chlorophenyl)methyl]-5-[3-(4-methylpiperazin-1-yl)prop-1-ynyl]-3H-isoindol-1-one Traditional Name: 7-chloro-2-(4-chlorobenzyl)-5-[3-(4-methylpiperazino)prop-1-ynyl]isoindolin-1-one Formula: C23H23Cl2N3O MolecularWeight: 428.35422

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC#CC2=CC3=C(C(=C2)Cl)C(=O)N(C3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)CC#CC2=CC3=C(C(=C2)Cl)C(=O)N(C3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H23Cl2N3O/c1-26-9-11-27(12-10-26)8-2-3-18-13-19-16-28(23(29)22(19)21(25)14-18)15-17-4-6-20(24)7-5-17/h4-7,13-14H,8-12,15-16H2,1H3