ethyl 2-[5-bromanyl-4-[(4S,5R)-5-ethanoyl-6-methylidene-2-oxidanylidene-1,3-diazinan-4-yl]-2-ethoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[5-bromanyl-4-[(4S,5R)-5-ethanoyl-6-methylidene-2-oxidanylidene-1,3-diazinan-4-yl]-2-ethoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(4S,5R)-5-acetyl-6-methylene-2-oxo-hexahydropyrimidin-4-yl]-5-bromo-2-ethoxy-phenoxy]acetate CAS Name: 2-[4-[(4S,5R)-5-acetyl-6-methylene-2-oxo-1,3-diazinan-4-yl]-5-bromo-2-ethoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(4S,5R)-5-acetyl-6-methylidene-2-oxo-1,3-diazinan-4-yl]-5-bromo-2-ethoxyphenoxy]acetate Traditional Name: 2-[4-[(4S,5R)-5-acetyl-2-keto-6-methylene-hexahydropyrimidin-4-yl]-5-bromo-2-ethoxy-phenoxy]acetic acid ethyl ester Formula: C19H23BrN2O6 MolecularWeight: 455.29972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2C(C(=C)NC(=O)N2)C(=O)C)Br)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)C)Br)OCC(=O)OCC

InChI

InChI=1S/C19H23BrN2O6/c1-5-26-14-7-12(13(20)8-15(14)28-9-16(24)27-6-2)18-17(11(4)23)10(3)21-19(25)22-18/h7-8,17-18H,3,5-6,9H2,1-2,4H3,(H2,21,22,25)/t17-,18-/m1/s1