8-(1-methoxy-2-oxidanyl-nonyl)-2-(2-propoxyphenyl)-1H-quinazolin-4-one

Systemtic Name: 8-(1-methoxy-2-oxidanyl-nonyl)-2-(2-propoxyphenyl)-1H-quinazolin-4-one Openeye Name: 8-(2-hydroxy-1-methoxy-nonyl)-2-(2-propoxyphenyl)-1H-quinazolin-4-one CAS Name: 8-(2-hydroxy-1-methoxynonyl)-2-(2-propoxyphenyl)-1H-quinazolin-4-one IUPAC Name: 8-(2-hydroxy-1-methoxynonyl)-2-(2-propoxyphenyl)-1H-quinazolin-4-one Traditional Name: 8-(2-hydroxy-1-methoxy-nonyl)-2-(2-propoxyphenyl)-1H-quinazolin-4-one Formula: C27H36N2O4 MolecularWeight: 452.58574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(C1=CC=CC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC)OC)O

Isomeric SMILES

CCCCCCCC(C(C1=CC=CC2=C1NC(=NC2=O)C3=CC=CC=C3OCCC)OC)O

InChI

InChI=1S/C27H36N2O4/c1-4-6-7-8-9-16-22(30)25(32-3)20-14-12-15-21-24(20)28-26(29-27(21)31)19-13-10-11-17-23(19)33-18-5-2/h10-15,17,22,25,30H,4-9,16,18H2,1-3H3,(H,28,29,31)