1-(3-fluoranyl-4-methoxy-phenyl)-4-(4-pyrrolidin-1-ylpiperidin-1-yl)butane-1,4-dione

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)-4-(4-pyrrolidin-1-ylpiperidin-1-yl)butane-1,4-dione Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(4-pyrrolidin-1-yl-1-piperidyl)butane-1,4-dione CAS Name: 1-(3-fluoro-4-methoxyphenyl)-4-[4-(1-pyrrolidinyl)-1-piperidinyl]butane-1,4-dione IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)-4-(4-pyrrolidin-1-ylpiperidin-1-yl)butane-1,4-dione Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(4-pyrrolidinopiperidino)butane-1,4-dione Formula: C20H27FN2O3 MolecularWeight: 362.438383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)N2CCC(CC2)N3CCCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)N2CCC(CC2)N3CCCC3)F

InChI

InChI=1S/C20H27FN2O3/c1-26-19-6-4-15(14-17(19)21)18(24)5-7-20(25)23-12-8-16(9-13-23)22-10-2-3-11-22/h4,6,14,16H,2-3,5,7-13H2,1H3