3-[(2-oxidanylidenechromen-3-yl)carbonylamino]propyl 4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoate

Systemtic Name: 3-[(2-oxidanylidenechromen-3-yl)carbonylamino]propyl 4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoate Openeye Name: 3-[(2-oxochromene-3-carbonyl)amino]propyl 4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoate CAS Name: 4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanoic acid 3-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]propyl ester IUPAC Name: 3-[(2-oxochromene-3-carbonyl)amino]propyl 4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanoate Traditional Name: 4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butyric acid 3-[(2-ketochromene-3-carbonyl)amino]propyl ester Formula: C25H25BrClNO6 MolecularWeight: 550.8261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)OCCCNC(=O)C2=CC3=CC=CC=C3OC2=O

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)OCCCNC(=O)C2=CC3=CC=CC=C3OC2=O

InChI

InChI=1S/C25H25BrClNO6/c1-15-13-20(22(26)16(2)23(15)27)32-11-5-9-21(29)33-12-6-10-28-24(30)18-14-17-7-3-4-8-19(17)34-25(18)31/h3-4,7-8,13-14H,5-6,9-12H2,1-2H3,(H,28,30)