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

Systemtic Name: 3,3-dimethyl-1-[2-(5-pyridin-3-yl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]butan-1-one Openeye Name: 3,3-dimethyl-1-[2-[5-(3-pyridyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]butan-1-one CAS Name: 3,3-dimethyl-1-[2-[5-(3-pyridinyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl]-1-butanone IUPAC Name: 3,3-dimethyl-1-[2-(5-pyridin-3-yl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]butan-1-one Traditional Name: 3,3-dimethyl-1-[2-[5-(3-pyridyl)-1,3-benzoxazol-2-yl]pyrrolidino]butan-1-one Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2/c1-22(2,3)13-20(26)25-11-5-7-18(25)21-24-17-12-15(8-9-19(17)27-21)16-6-4-10-23-14-16/h4,6,8-10,12,14,18H,5,7,11,13H2,1-3H3