methyl 4-[1-fluoranyl-3-(7-fluoranyl-1,3-benzoxazol-6-yl)-3-isoquinolin-1-yl-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[1-fluoranyl-3-(7-fluoranyl-1,3-benzoxazol-6-yl)-3-isoquinolin-1-yl-2-oxidanylidene-1-pyrrolidin-1-yl-propoxy]cyclohexane-1-carboxylate Openeye Name: methyl 4-[1-fluoro-3-(7-fluoro-1,3-benzoxazol-6-yl)-3-(1-isoquinolyl)-2-oxo-1-pyrrolidin-1-yl-propoxy]cyclohexanecarboxylate CAS Name: 4-[1-fluoro-3-(7-fluoro-1,3-benzoxazol-6-yl)-3-(1-isoquinolinyl)-2-oxo-1-(1-pyrrolidinyl)propoxy]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[1-fluoro-3-(7-fluoro-1,3-benzoxazol-6-yl)-3-isoquinolin-1-yl-2-oxo-1-pyrrolidin-1-ylpropoxy]cyclohexane-1-carboxylate Traditional Name: 4-[1-fluoro-3-(7-fluoro-1,3-benzoxazol-6-yl)-3-(1-isoquinolyl)-2-keto-1-pyrrolidino-propoxy]cyclohexanecarboxylic acid methyl ester Formula: C31H31F2N3O5 MolecularWeight: 563.591746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)OC(C(=O)C(C2=C(C3=C(C=C2)N=CO3)F)C4=NC=CC5=CC=CC=C54)(N6CCCC6)F

Isomeric SMILES

COC(=O)C1CCC(CC1)OC(C(=O)C(C2=C(C3=C(C=C2)N=CO3)F)C4=NC=CC5=CC=CC=C54)(N6CCCC6)F

InChI

InChI=1S/C31H31F2N3O5/c1-39-30(38)20-8-10-21(11-9-20)41-31(33,36-16-4-5-17-36)29(37)25(23-12-13-24-28(26(23)32)40-18-35-24)27-22-7-3-2-6-19(22)14-15-34-27/h2-3,6-7,12-15,18,20-21,25H,4-5,8-11,16-17H2,1H3