6,7-bis(chloranyl)-3-(3-morpholin-4-yl-2-oxidanyl-propyl)-6H-quinazolin-3-ium-4-one

Systemtic Name: 6,7-bis(chloranyl)-3-(3-morpholin-4-yl-2-oxidanyl-propyl)-6H-quinazolin-3-ium-4-one Openeye Name: 6,7-dichloro-3-(2-hydroxy-3-morpholino-propyl)-6H-quinazolin-3-ium-4-one CAS Name: 6,7-dichloro-3-[2-hydroxy-3-(4-morpholinyl)propyl]-6H-quinazolin-3-ium-4-one IUPAC Name: 6,7-dichloro-3-(2-hydroxy-3-morpholin-4-ylpropyl)-6H-quinazolin-3-ium-4-one Traditional Name: 6,7-dichloro-3-(2-hydroxy-3-morpholino-propyl)-6H-quinazolin-3-ium-4-one Formula: C15H18Cl2N3O3+ MolecularWeight: 359.22772

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(C[N+]2=CN=C3C=C(C(C=C3C2=O)Cl)Cl)O

Isomeric SMILES

C1COCCN1CC(C[N+]2=CN=C3C=C(C(C=C3C2=O)Cl)Cl)O

InChI

InChI=1S/C15H18Cl2N3O3/c16-12-5-11-14(6-13(12)17)18-9-20(15(11)22)8-10(21)7-19-1-3-23-4-2-19/h5-6,9-10,12,21H,1-4,7-8H2/q+1