2-[(3,5-dimethoxyphenyl)carbonylamino]-N-(2-fluorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 2-[(3,5-dimethoxyphenyl)carbonylamino]-N-(2-fluorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-[(3,5-dimethoxybenzoyl)amino]-N-(2-fluorophenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-N-(2-fluorophenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-[(3,5-dimethoxybenzoyl)amino]-N-(2-fluorophenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-[(3,5-dimethoxybenzoyl)amino]-N-(2-fluorophenyl)-1-keto-isoquinoline-4-carboxamide Formula: C25H20FN3O5 MolecularWeight: 461.441803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NN2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC=CC=C4F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NN2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC=CC=C4F)OC

InChI

InChI=1S/C25H20FN3O5/c1-33-16-11-15(12-17(13-16)34-2)23(30)28-29-14-20(18-7-3-4-8-19(18)25(29)32)24(31)27-22-10-6-5-9-21(22)26/h3-14H,1-2H3,(H,27,31)(H,28,30)