2-[5-chloranyl-2-fluoranyl-4-(isoquinolin-1-ylcarbonylamino)phenyl]ethanoate

Systemtic Name: 2-[5-chloranyl-2-fluoranyl-4-(isoquinolin-1-ylcarbonylamino)phenyl]ethanoate Openeye Name: 2-[5-chloro-2-fluoro-4-(isoquinoline-1-carbonylamino)phenyl]acetate CAS Name: 2-[5-chloro-2-fluoro-4-[[1-isoquinolinyl(oxo)methyl]amino]phenyl]acetate IUPAC Name: 2-[5-chloro-2-fluoro-4-(isoquinoline-1-carbonylamino)phenyl]acetate Traditional Name: 2-[5-chloro-2-fluoro-4-(isoquinoline-1-carbonylamino)phenyl]acetate Formula: C18H11ClFN2O3- MolecularWeight: 357.742943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2C(=O)NC3=C(C=C(C(=C3)F)CC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2C(=O)NC3=C(C=C(C(=C3)F)CC(=O)[O-])Cl

InChI

InChI=1S/C18H12ClFN2O3/c19-13-7-11(8-16(23)24)14(20)9-15(13)22-18(25)17-12-4-2-1-3-10(12)5-6-21-17/h1-7,9H,8H2,(H,22,25)(H,23,24)/p-1