N-(4-fluorophenyl)-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide

Systemtic Name: N-(4-fluorophenyl)-1-[(2-methoxyphenyl)amino]isoquinoline-4-carboxamide Openeye Name: N-(4-fluorophenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide CAS Name: N-(4-fluorophenyl)-1-(2-methoxyanilino)-4-isoquinolinecarboxamide IUPAC Name: N-(4-fluorophenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide Traditional Name: N-(4-fluorophenyl)-1-(o-anisidino)isoquinoline-4-carboxamide Formula: C23H18FN3O2 MolecularWeight: 387.406323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC=C(C3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1NC2=NC=C(C3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C23H18FN3O2/c1-29-21-9-5-4-8-20(21)27-22-18-7-3-2-6-17(18)19(14-25-22)23(28)26-16-12-10-15(24)11-13-16/h2-14H,1H3,(H,25,27)(H,26,28)