6,8-bis(chloranyl)-3-(4-methoxyphenyl)-2-pyridin-3-yl-4aH-quinazolin-3-ium-4-one

Systemtic Name: 6,8-bis(chloranyl)-3-(4-methoxyphenyl)-2-pyridin-3-yl-4aH-quinazolin-3-ium-4-one Openeye Name: 6,8-dichloro-3-(4-methoxyphenyl)-2-(3-pyridyl)-4aH-quinazolin-3-ium-4-one CAS Name: 6,8-dichloro-3-(4-methoxyphenyl)-2-(3-pyridinyl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 6,8-dichloro-3-(4-methoxyphenyl)-2-pyridin-3-yl-4aH-quinazolin-3-ium-4-one Traditional Name: 6,8-dichloro-3-(4-methoxyphenyl)-2-(3-pyridyl)-4aH-quinazolin-3-ium-4-one Formula: C20H14Cl2N3O2+ MolecularWeight: 399.25006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N+]2=C(N=C3C(C2=O)C=C(C=C3Cl)Cl)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[N+]2=C(N=C3C(C2=O)C=C(C=C3Cl)Cl)C4=CN=CC=C4

InChI

InChI=1S/C20H14Cl2N3O2/c1-27-15-6-4-14(5-7-15)25-19(12-3-2-8-23-11-12)24-18-16(20(25)26)9-13(21)10-17(18)22/h2-11,16H,1H3/q+1