[(2S,3S)-3-acetyloxy-5,6-bis(4-bromophenyl)-2,3-dihydropyrazin-2-yl] ethanoate

Systemtic Name: [(2S,3S)-3-acetyloxy-5,6-bis(4-bromophenyl)-2,3-dihydropyrazin-2-yl] ethanoate Openeye Name: [(2S,3S)-3-acetoxy-5,6-bis(4-bromophenyl)-2,3-dihydropyrazin-2-yl] acetate CAS Name: acetic acid [(2S,3S)-3-acetyloxy-5,6-bis(4-bromophenyl)-2,3-dihydropyrazin-2-yl] ester IUPAC Name: [(2S,3S)-3-acetyloxy-5,6-bis(4-bromophenyl)-2,3-dihydropyrazin-2-yl] acetate Traditional Name: acetic acid [(2S,3S)-3-acetoxy-5,6-bis(4-bromophenyl)-2,3-dihydropyrazin-2-yl] ester Formula: C20H16Br2N2O4 MolecularWeight: 508.16004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(N=C(C(=N1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br)OC(=O)C

Isomeric SMILES

CC(=O)O[C@H]1[C@@H](N=C(C(=N1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br)OC(=O)C

InChI

InChI=1S/C20H16Br2N2O4/c1-11(25)27-19-20(28-12(2)26)24-18(14-5-9-16(22)10-6-14)17(23-19)13-3-7-15(21)8-4-13/h3-10,19-20H,1-2H3/t19-,20-/m0/s1