6-[[4-(4-bromanyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]amino]-4-methyl-2,3-benzoxazin-1-one

Systemtic Name: 6-[[4-(4-bromanyl-2-methoxy-phenyl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]amino]-4-methyl-2,3-benzoxazin-1-one Openeye Name: 6-[[4-(4-bromo-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-4-methyl-2,3-benzoxazin-1-one CAS Name: 6-[[4-(4-bromo-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-4-methyl-2,3-benzoxazin-1-one IUPAC Name: 6-[[4-(4-bromo-2-methoxyphenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-4-methyl-2,3-benzoxazin-1-one Traditional Name: 6-[[4-(4-bromo-2-methoxy-phenyl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino]-4-methyl-2,3-benzoxazin-1-one Formula: C23H24BrF3N2O4 MolecularWeight: 529.34687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=O)C2=C1C=C(C=C2)NCC(CC(C)(C)C3=C(C=C(C=C3)Br)OC)(C(F)(F)F)O

Isomeric SMILES

CC1=NOC(=O)C2=C1C=C(C=C2)NCC(CC(C)(C)C3=C(C=C(C=C3)Br)OC)(C(F)(F)F)O

InChI

InChI=1S/C23H24BrF3N2O4/c1-13-17-10-15(6-7-16(17)20(30)33-29-13)28-12-22(31,23(25,26)27)11-21(2,3)18-8-5-14(24)9-19(18)32-4/h5-10,28,31H,11-12H2,1-4H3