1-[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]-1,3-diazinan-2-one

Systemtic Name: 1-[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]-1,3-diazinan-2-one Openeye Name: 1-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-phenyl]hexahydropyrimidin-2-one CAS Name: 1-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]-1,3-diazinan-2-one IUPAC Name: 1-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylphenyl]-1,3-diazinan-2-one Traditional Name: 1-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-phenyl]hexahydropyrimidin-2-one Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(C)C)C)N3CCCNC3=O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(C)C)C)N3CCCNC3=O

InChI

InChI=1S/C21H26N2O3/c1-13(2)18-12-17(6-7-19(18)24)26-20-14(3)10-16(11-15(20)4)23-9-5-8-22-21(23)25/h6-7,10-13,24H,5,8-9H2,1-4H3,(H,22,25)