(3Z)-3-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methylidene]-2-benzofuran-1-one

Systemtic Name: (3Z)-3-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methylidene]-2-benzofuran-1-one Openeye Name: (3Z)-3-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methylene]isobenzofuran-1-one CAS Name: (3Z)-3-[[4-(4-chlorophenyl)-1-piperazin-1-iumyl]methylidene]-1-isobenzofuranone IUPAC Name: (3Z)-3-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methylidene]-2-benzofuran-1-one Traditional Name: (3Z)-3-[[4-(4-chlorophenyl)piperazin-1-ium-1-yl]methylene]phthalide Formula: C19H18ClN2O2+ MolecularWeight: 341.81142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C=C2C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1/C=C\2/C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H17ClN2O2/c20-14-5-7-15(8-6-14)22-11-9-21(10-12-22)13-18-16-3-1-2-4-17(16)19(23)24-18/h1-8,13H,9-12H2/p+1/b18-13-