(2-azanyl-4,6-dimethoxy-phenyl)-[(2S,3R)-3-(4-bromophenyl)oxiran-2-yl]methanone

Systemtic Name: (2-azanyl-4,6-dimethoxy-phenyl)-[(2S,3R)-3-(4-bromophenyl)oxiran-2-yl]methanone Openeye Name: (2-amino-4,6-dimethoxy-phenyl)-[(2S,3R)-3-(4-bromophenyl)oxiran-2-yl]methanone CAS Name: (2-amino-4,6-dimethoxyphenyl)-[(2S,3R)-3-(4-bromophenyl)-2-oxiranyl]methanone IUPAC Name: (2-amino-4,6-dimethoxyphenyl)-[(2S,3R)-3-(4-bromophenyl)oxiran-2-yl]methanone Traditional Name: (2-amino-4,6-dimethoxy-phenyl)-[(2S,3R)-3-(4-bromophenyl)oxiran-2-yl]methanone Formula: C17H16BrNO4 MolecularWeight: 378.21724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)N)C(=O)C2C(O2)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)N)C(=O)[C@@H]2[C@H](O2)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C17H16BrNO4/c1-21-11-7-12(19)14(13(8-11)22-2)15(20)17-16(23-17)9-3-5-10(18)6-4-9/h3-8,16-17H,19H2,1-2H3/t16-,17-/m1/s1