1-[1-(3-fluorophenyl)-7-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)oxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-butan-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]-3-methyl-butan-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]-3-methyl-butan-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]-3-methyl-1-butanone IUPAC Name: 1-[1-(3-fluorophenyl)-7-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)oxy-3,4-dihydro-1H-isoquinolin-2-yl]-3-methylbutan-1-one Traditional Name: 1-[1-(3-fluorophenyl)-7-(2-keto-1-methyl-2-pyrrolidino-ethoxy)-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-butan-1-one Formula: C27H33FN2O3 MolecularWeight: 452.560923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2=C(C1C3=CC(=CC=C3)F)C=C(C=C2)OC(C)C(=O)N4CCCC4

Isomeric SMILES

CC(C)CC(=O)N1CCC2=C(C1C3=CC(=CC=C3)F)C=C(C=C2)OC(C)C(=O)N4CCCC4

InChI

InChI=1S/C27H33FN2O3/c1-18(2)15-25(31)30-14-11-20-9-10-23(33-19(3)27(32)29-12-4-5-13-29)17-24(20)26(30)21-7-6-8-22(28)16-21/h6-10,16-19,26H,4-5,11-15H2,1-3H3