2-[2-[[5-[5-[3-chloranyl-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]isoquinolin-8-yl]carbonylamino]ethoxy]ethyl N-methylcarbamate

Systemtic Name: 2-[2-[[5-[5-[3-chloranyl-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]isoquinolin-8-yl]carbonylamino]ethoxy]ethyl N-methylcarbamate Openeye Name: 2-[2-[[5-[5-[3-chloro-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-isoxazol-3-yl]isoquinoline-8-carbonyl]amino]ethoxy]ethyl N-methylcarbamate CAS Name: N-methylcarbamic acid 2-[2-[[[5-[5-[3-chloro-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-isoxazol-3-yl]-8-isoquinolinyl]-oxomethyl]amino]ethoxy]ethyl ester IUPAC Name: 2-[2-[[5-[5-[3-chloro-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]isoquinoline-8-carbonyl]amino]ethoxy]ethyl N-methylcarbamate Traditional Name: N-methylcarbamic acid 2-[2-[[5-[5-[3-chloro-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-2-isoxazolin-3-yl]isoquinoline-8-carbonyl]amino]ethoxy]ethyl ester Formula: C27H23ClF6N4O5 MolecularWeight: 632.938739

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OCCOCCNC(=O)C1=C2C=NC=CC2=C(C=C1)C3=NOC(C3)(C4=CC(=CC(=C4)Cl)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CNC(=O)OCCOCCNC(=O)C1=C2C=NC=CC2=C(C=C1)C3=NOC(C3)(C4=CC(=CC(=C4)Cl)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C27H23ClF6N4O5/c1-35-24(40)42-9-8-41-7-6-37-23(39)20-3-2-19(18-4-5-36-14-21(18)20)22-13-25(43-38-22,27(32,33)34)15-10-16(26(29,30)31)12-17(28)11-15/h2-5,10-12,14H,6-9,13H2,1H3,(H,35,40)(H,37,39)