1-[2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]heptan-1-one

Systemtic Name: 1-[2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]heptan-1-one Openeye Name: 1-[2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]heptan-1-one CAS Name: 1-[2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl]-1-heptanone IUPAC Name: 1-[2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]heptan-1-one Traditional Name: 1-[2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidino]heptan-1-one Formula: C25H30N2O3 MolecularWeight: 406.5173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCCC1C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4OC

Isomeric SMILES

CCCCCCC(=O)N1CCCC1C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4OC

InChI

InChI=1S/C25H30N2O3/c1-3-4-5-6-13-24(28)27-16-9-11-21(27)25-26-20-17-18(14-15-23(20)30-25)19-10-7-8-12-22(19)29-2/h7-8,10,12,14-15,17,21H,3-6,9,11,13,16H2,1-2H3