N-[1-[4-(4-aminocarbonylphenyl)-2-fluoranyl-phenyl]ethyl]-2-(1,3-benzodioxol-5-yloxy)pyridine-3-carboxamide

Systemtic Name: N-[1-[4-(4-aminocarbonylphenyl)-2-fluoranyl-phenyl]ethyl]-2-(1,3-benzodioxol-5-yloxy)pyridine-3-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-yloxy)-N-[1-[4-(4-carbamoylphenyl)-2-fluoro-phenyl]ethyl]pyridine-3-carboxamide CAS Name: 2-(1,3-benzodioxol-5-yloxy)-N-[1-[4-(4-carbamoylphenyl)-2-fluorophenyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-yloxy)-N-[1-[4-(4-carbamoylphenyl)-2-fluorophenyl]ethyl]pyridine-3-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-yloxy)-N-[1-[4-(4-carbamoylphenyl)-2-fluoro-phenyl]ethyl]nicotinamide Formula: C28H22FN3O5 MolecularWeight: 499.489783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)N)F)NC(=O)C3=C(N=CC=C3)OC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)N)F)NC(=O)C3=C(N=CC=C3)OC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H22FN3O5/c1-16(21-10-8-19(13-23(21)29)17-4-6-18(7-5-17)26(30)33)32-27(34)22-3-2-12-31-28(22)37-20-9-11-24-25(14-20)36-15-35-24/h2-14,16H,15H2,1H3,(H2,30,33)(H,32,34)