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

Systemtic Name: 1-[2-(5-pyridin-3-yl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]heptan-1-one Openeye Name: 1-[2-[5-(3-pyridyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]heptan-1-one CAS Name: 1-[2-[5-(3-pyridinyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl]-1-heptanone IUPAC Name: 1-[2-(5-pyridin-3-yl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]heptan-1-one Traditional Name: 1-[2-[5-(3-pyridyl)-1,3-benzoxazol-2-yl]pyrrolidino]heptan-1-one Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O2/c1-2-3-4-5-10-22(27)26-14-7-9-20(26)23-25-19-15-17(11-12-21(19)28-23)18-8-6-13-24-16-18/h6,8,11-13,15-16,20H,2-5,7,9-10,14H2,1H3