4-[(7-chloranyl-3,5-dimethyl-1-benzofuran-2-yl)carbonyl]-3-(3-fluorophenyl)piperazin-2-one

Systemtic Name: 4-[(7-chloranyl-3,5-dimethyl-1-benzofuran-2-yl)carbonyl]-3-(3-fluorophenyl)piperazin-2-one Openeye Name: 4-(7-chloro-3,5-dimethyl-benzofuran-2-carbonyl)-3-(3-fluorophenyl)piperazin-2-one CAS Name: 4-[(7-chloro-3,5-dimethyl-2-benzofuranyl)-oxomethyl]-3-(3-fluorophenyl)-2-piperazinone IUPAC Name: 4-(7-chloro-3,5-dimethyl-1-benzofuran-2-carbonyl)-3-(3-fluorophenyl)piperazin-2-one Traditional Name: 4-(7-chloro-3,5-dimethyl-benzofuran-2-carbonyl)-3-(3-fluorophenyl)piperazin-2-one Formula: C21H18ClFN2O3 MolecularWeight: 400.830623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)N3CCNC(=O)C3C4=CC(=CC=C4)F)C)Cl

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)N3CCNC(=O)C3C4=CC(=CC=C4)F)C)Cl

InChI

InChI=1S/C21H18ClFN2O3/c1-11-8-15-12(2)18(28-19(15)16(22)9-11)21(27)25-7-6-24-20(26)17(25)13-4-3-5-14(23)10-13/h3-5,8-10,17H,6-7H2,1-2H3,(H,24,26)