3-(4-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-4H-isochromen-1-one

Systemtic Name: 3-(4-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-4H-isochromen-1-one Openeye Name: 3-(4-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]isochroman-1-one CAS Name: 3-(4-chlorophenyl)-3-[2-(4-methyl-1-piperazinyl)ethyl]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-(4-chlorophenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-4H-isochromen-1-one Traditional Name: 3-(4-chlorophenyl)-3-[2-(4-methylpiperazino)ethyl]isochroman-1-one Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC2(CC3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)CCC2(CC3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H25ClN2O2/c1-24-12-14-25(15-13-24)11-10-22(18-6-8-19(23)9-7-18)16-17-4-2-3-5-20(17)21(26)27-22/h2-9H,10-16H2,1H3