7-chloranyl-2-[[ethyl-[3-(4-fluoranylphenoxy)-2-oxidanyl-propyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[ethyl-[3-(4-fluoranylphenoxy)-2-oxidanyl-propyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[ethyl-[3-(4-fluorophenoxy)-2-hydroxy-propyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[ethyl-[3-(4-fluorophenoxy)-2-hydroxypropyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[ethyl-[3-(4-fluorophenoxy)-2-hydroxypropyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[ethyl-[3-(4-fluorophenoxy)-2-hydroxy-propyl]amino]methyl]-1H-quinazolin-4-one Formula: C20H21ClFN3O3 MolecularWeight: 405.850443

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(COC3=CC=C(C=C3)F)O

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(COC3=CC=C(C=C3)F)O

InChI

InChI=1S/C20H21ClFN3O3/c1-2-25(10-15(26)12-28-16-6-4-14(22)5-7-16)11-19-23-18-9-13(21)3-8-17(18)20(27)24-19/h3-9,15,26H,2,10-12H2,1H3,(H,23,24,27)