3-[4-(3-chlorophenyl)piperazin-1-yl]carbonylisochromen-1-one

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]carbonylisochromen-1-one Openeye Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]isochromen-1-one CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-2-benzopyran-1-one IUPAC Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]isochromen-1-one Traditional Name: 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]isocoumarin Formula: C20H17ClN2O3 MolecularWeight: 368.81358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C20H17ClN2O3/c21-15-5-3-6-16(13-15)22-8-10-23(11-9-22)19(24)18-12-14-4-1-2-7-17(14)20(25)26-18/h1-7,12-13H,8-11H2