methyl (3aS,4S,9bS)-4-(3-oxidanylpropyl)-1,5-bis[2,2,2-tris(fluoranyl)ethanoyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-8-carboxylate

Systemtic Name: methyl (3aS,4S,9bS)-4-(3-oxidanylpropyl)-1,5-bis[2,2,2-tris(fluoranyl)ethanoyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-8-carboxylate Openeye Name: methyl (3aS,4S,9bS)-4-(3-hydroxypropyl)-1,5-bis(2,2,2-trifluoroacetyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-8-carboxylate CAS Name: (3aS,4S,9bS)-4-(3-hydroxypropyl)-1,5-bis(2,2,2-trifluoro-1-oxoethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-8-carboxylic acid methyl ester IUPAC Name: methyl (3aS,4S,9bS)-4-(3-hydroxypropyl)-1,5-bis(2,2,2-trifluoroacetyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-8-carboxylate Traditional Name: (3aS,4S,9bS)-4-(3-hydroxypropyl)-1,5-bis(2,2,2-trifluoroacetyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-8-carboxylic acid methyl ester Formula: C20H20F6N2O5 MolecularWeight: 482.373619

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C(C3C2N(CC3)C(=O)C(F)(F)F)CCCO)C(=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N([C@H]([C@H]3[C@@H]2N(CC3)C(=O)C(F)(F)F)CCCO)C(=O)C(F)(F)F

InChI

InChI=1S/C20H20F6N2O5/c1-33-16(30)10-4-5-14-12(9-10)15-11(6-7-27(15)17(31)19(21,22)23)13(3-2-8-29)28(14)18(32)20(24,25)26/h4-5,9,11,13,15,29H,2-3,6-8H2,1H3/t11-,13-,15-/m0/s1