methyl 1-[(2-fluorophenyl)amino]isoquinoline-4-carboxylate

Systemtic Name: methyl 1-[(2-fluorophenyl)amino]isoquinoline-4-carboxylate Openeye Name: methyl 1-(2-fluoroanilino)isoquinoline-4-carboxylate CAS Name: 1-(2-fluoroanilino)-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-fluoroanilino)isoquinoline-4-carboxylate Traditional Name: 1-(2-fluoroanilino)isoquinoline-4-carboxylic acid methyl ester Formula: C17H13FN2O2 MolecularWeight: 296.295723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C2=CC=CC=C21)NC3=CC=CC=C3F

Isomeric SMILES

COC(=O)C1=CN=C(C2=CC=CC=C21)NC3=CC=CC=C3F

InChI

InChI=1S/C17H13FN2O2/c1-22-17(21)13-10-19-16(12-7-3-2-6-11(12)13)20-15-9-5-4-8-14(15)18/h2-10H,1H3,(H,19,20)