N-(4-cyanophenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide

Systemtic Name: N-(4-cyanophenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide CAS Name: N-(4-cyanophenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide IUPAC Name: N-(4-cyanophenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidine-1-carboxamide Formula: C26H22N4O3 MolecularWeight: 438.47788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)NC5=CC=C(C=C5)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)NC5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H22N4O3/c1-32-21-5-2-4-18(14-21)19-9-12-24-22(15-19)29-25(33-24)23-6-3-13-30(23)26(31)28-20-10-7-17(16-27)8-11-20/h2,4-5,7-12,14-15,23H,3,6,13H2,1H3,(H,28,31)