N-[(E)-[1-(2-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-phenoxy-ethanamide

Systemtic Name: N-[(E)-[1-(2-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-phenoxy-ethanamide Openeye Name: N-[(E)-[1-(2-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-phenoxy-acetamide CAS Name: N-[(E)-[1-(2-bromophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-phenoxyacetamide IUPAC Name: N-[(E)-[1-(2-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-phenoxyacetamide Traditional Name: N-[(E)-[1-(2-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-phenoxy-acetamide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2Br)C)C=NNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2Br)C)/C=N/NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H20BrN3O2/c1-15-12-17(16(2)25(15)20-11-7-6-10-19(20)22)13-23-24-21(26)14-27-18-8-4-3-5-9-18/h3-13H,14H2,1-2H3,(H,24,26)/b23-13+