3-[2-[4-(2-fluorophenyl)piperazin-1-yl]carbonylphenyl]isochromen-1-one

Systemtic Name: 3-[2-[4-(2-fluorophenyl)piperazin-1-yl]carbonylphenyl]isochromen-1-one Openeye Name: 3-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl]isochromen-1-one CAS Name: 3-[2-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]phenyl]-2-benzopyran-1-one IUPAC Name: 3-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl]isochromen-1-one Traditional Name: 3-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl]isocoumarin Formula: C26H21FN2O3 MolecularWeight: 428.454943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)C3=CC=CC=C3C4=CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)C3=CC=CC=C3C4=CC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C26H21FN2O3/c27-22-11-5-6-12-23(22)28-13-15-29(16-14-28)25(30)21-10-4-3-9-20(21)24-17-18-7-1-2-8-19(18)26(31)32-24/h1-12,17H,13-16H2