1-[4-(3-bromanyl-4-methoxy-phenoxy)-3,5-dimethyl-phenyl]-6-morpholin-4-ylcarbonyl-1,2,4-triazinane-3,5-dione

Systemtic Name: 1-[4-(3-bromanyl-4-methoxy-phenoxy)-3,5-dimethyl-phenyl]-6-morpholin-4-ylcarbonyl-1,2,4-triazinane-3,5-dione Openeye Name: 1-[4-(3-bromo-4-methoxy-phenoxy)-3,5-dimethyl-phenyl]-6-(morpholine-4-carbonyl)-1,2,4-triazinane-3,5-dione CAS Name: 1-[4-(3-bromo-4-methoxyphenoxy)-3,5-dimethylphenyl]-6-[4-morpholinyl(oxo)methyl]-1,2,4-triazinane-3,5-dione IUPAC Name: 1-[4-(3-bromo-4-methoxyphenoxy)-3,5-dimethylphenyl]-6-(morpholine-4-carbonyl)-1,2,4-triazinane-3,5-dione Traditional Name: 1-[4-(3-bromo-4-methoxy-phenoxy)-3,5-dimethyl-phenyl]-6-(morpholine-4-carbonyl)-1,2,4-triazinane-3,5-quinone Formula: C23H25BrN4O6 MolecularWeight: 533.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)OC)Br)C)N3C(C(=O)NC(=O)N3)C(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)OC)Br)C)N3C(C(=O)NC(=O)N3)C(=O)N4CCOCC4

InChI

InChI=1S/C23H25BrN4O6/c1-13-10-15(11-14(2)20(13)34-16-4-5-18(32-3)17(24)12-16)28-19(21(29)25-23(31)26-28)22(30)27-6-8-33-9-7-27/h4-5,10-12,19H,6-9H2,1-3H3,(H2,25,26,29,31)