1-cyclohexyl-4-[3-(4-fluoranyl-1-benzofuran-7-yl)pyrrolidin-1-yl]-2-pyridin-2-yl-butan-1-one

Systemtic Name: 1-cyclohexyl-4-[3-(4-fluoranyl-1-benzofuran-7-yl)pyrrolidin-1-yl]-2-pyridin-2-yl-butan-1-one Openeye Name: 1-cyclohexyl-4-[3-(4-fluorobenzofuran-7-yl)pyrrolidin-1-yl]-2-(2-pyridyl)butan-1-one CAS Name: 1-cyclohexyl-4-[3-(4-fluoro-7-benzofuranyl)-1-pyrrolidinyl]-2-(2-pyridinyl)-1-butanone IUPAC Name: 1-cyclohexyl-4-[3-(4-fluoro-1-benzofuran-7-yl)pyrrolidin-1-yl]-2-pyridin-2-ylbutan-1-one Traditional Name: 1-cyclohexyl-4-[3-(4-fluorobenzofuran-7-yl)pyrrolidino]-2-(2-pyridyl)butan-1-one Formula: C27H31FN2O2 MolecularWeight: 434.545643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C(CCN2CCC(C2)C3=C4C(=C(C=C3)F)C=CO4)C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)C(=O)C(CCN2CCC(C2)C3=C4C(=C(C=C3)F)C=CO4)C5=CC=CC=N5

InChI

InChI=1S/C27H31FN2O2/c28-24-10-9-21(27-22(24)13-17-32-27)20-11-15-30(18-20)16-12-23(25-8-4-5-14-29-25)26(31)19-6-2-1-3-7-19/h4-5,8-10,13-14,17,19-20,23H,1-3,6-7,11-12,15-16,18H2