1-[1-(4-fluorophenyl)-7-[(5-pyrrolidin-1-ylcarbonylfuran-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one

Systemtic Name: 1-[1-(4-fluorophenyl)-7-[(5-pyrrolidin-1-ylcarbonylfuran-2-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Openeye Name: 1-[1-(4-fluorophenyl)-7-[[5-(pyrrolidine-1-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one CAS Name: 1-[1-(4-fluorophenyl)-7-[[5-[oxo(1-pyrrolidinyl)methyl]-2-furanyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]-1-propanone IUPAC Name: 1-[1-(4-fluorophenyl)-7-[[5-(pyrrolidine-1-carbonyl)furan-2-yl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Traditional Name: 1-[1-(4-fluorophenyl)-7-[[5-(pyrrolidine-1-carbonyl)-2-furyl]methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Formula: C28H29FN2O4 MolecularWeight: 476.539263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC4=CC=C(O4)C(=O)N5CCCC5

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC4=CC=C(O4)C(=O)N5CCCC5

InChI

InChI=1S/C28H29FN2O4/c1-2-26(32)31-16-13-19-7-10-22(17-24(19)27(31)20-5-8-21(29)9-6-20)34-18-23-11-12-25(35-23)28(33)30-14-3-4-15-30/h5-12,17,27H,2-4,13-16,18H2,1H3