2-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-4-one

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-4-one Openeye Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3,6,6-trimethyl-5,7-dihydrobenzofuran-4-one CAS Name: 2-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-3,6,6-trimethyl-5,7-dihydrobenzofuran-4-one IUPAC Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-4-one Traditional Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3,6,6-trimethyl-5,7-dihydrobenzofuran-4-one Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H25ClN2O3/c1-14-19-17(26)12-22(2,3)13-18(19)28-20(14)21(27)25-9-7-24(8-10-25)16-6-4-5-15(23)11-16/h4-6,11H,7-10,12-13H2,1-3H3