9-chloranyl-1-methyl-2-oxidanyl-3-phenyl-6H-pyrimido[2,1-a]isoindol-1-ium-4-one

Systemtic Name: 9-chloranyl-1-methyl-2-oxidanyl-3-phenyl-6H-pyrimido[2,1-a]isoindol-1-ium-4-one Openeye Name: 9-chloro-2-hydroxy-1-methyl-3-phenyl-6H-pyrimido[2,1-a]isoindol-1-ium-4-one CAS Name: 9-chloro-2-hydroxy-1-methyl-3-phenyl-6H-pyrimido[2,1-a]isoindol-1-ium-4-one IUPAC Name: 9-chloro-2-hydroxy-1-methyl-3-phenyl-6H-pyrimido[2,1-a]isoindol-1-ium-4-one Traditional Name: 9-chloro-2-hydroxy-1-methyl-3-phenyl-6H-pyrimid[2,1-a]isoindol-1-ium-4-one Formula: C18H14ClN2O2+ MolecularWeight: 325.76896

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C3=C(CN2C(=O)C(=C1O)C4=CC=CC=C4)C=CC(=C3)Cl

Isomeric SMILES

C[N+]1=C2C3=C(CN2C(=O)C(=C1O)C4=CC=CC=C4)C=CC(=C3)Cl

InChI

InChI=1S/C18H13ClN2O2/c1-20-16-14-9-13(19)8-7-12(14)10-21(16)18(23)15(17(20)22)11-5-3-2-4-6-11/h2-9H,10H2,1H3/p+1