1-[1-(3-fluorophenyl)-7-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)oxy-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[1-(3-fluorophenyl)-7-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)oxy-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[1-(3-fluorophenyl)-7-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[1-(3-fluorophenyl)-7-[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]oxy-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[1-(3-fluorophenyl)-7-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)oxy-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[1-(3-fluorophenyl)-7-(2-keto-1-methyl-2-pyrrolidino-ethoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-2,2-dimethyl-propan-1-one Formula: C27H33FN2O3 MolecularWeight: 452.560923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)C(C)(C)C)C=C2

Isomeric SMILES

CC(C(=O)N1CCCC1)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)C(C)(C)C)C=C2

InChI

InChI=1S/C27H33FN2O3/c1-18(25(31)29-13-5-6-14-29)33-22-11-10-19-12-15-30(26(32)27(2,3)4)24(23(19)17-22)20-8-7-9-21(28)16-20/h7-11,16-18,24H,5-6,12-15H2,1-4H3