1-(1,3-benzoxazol-2-yl)-N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]isonipecotamide Formula: C23H26BrN3O4 MolecularWeight: 488.37424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)Br)OC

InChI

InChI=1S/C23H26BrN3O4/c1-29-20-13-16(17(24)14-21(20)30-2)7-10-25-22(28)15-8-11-27(12-9-15)23-26-18-5-3-4-6-19(18)31-23/h3-6,13-15H,7-12H2,1-2H3,(H,25,28)