N-[4-fluoranyl-2-[(4-methoxyphenyl)carbamoyl]phenyl]-1-pyridin-4-yl-piperidine-4-carboxamide

Systemtic Name: N-[4-fluoranyl-2-[(4-methoxyphenyl)carbamoyl]phenyl]-1-pyridin-4-yl-piperidine-4-carboxamide Openeye Name: N-[4-fluoro-2-[(4-methoxyphenyl)carbamoyl]phenyl]-1-(4-pyridyl)piperidine-4-carboxamide CAS Name: N-[4-fluoro-2-[(4-methoxyanilino)-oxomethyl]phenyl]-1-pyridin-4-yl-4-piperidinecarboxamide IUPAC Name: N-[4-fluoro-2-[(4-methoxyphenyl)carbamoyl]phenyl]-1-pyridin-4-ylpiperidine-4-carboxamide Traditional Name: N-[4-fluoro-2-[(4-methoxyphenyl)carbamoyl]phenyl]-1-(4-pyridyl)isonipecotamide Formula: C25H25FN4O3 MolecularWeight: 448.489403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)F)NC(=O)C3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)F)NC(=O)C3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C25H25FN4O3/c1-33-21-5-3-19(4-6-21)28-25(32)22-16-18(26)2-7-23(22)29-24(31)17-10-14-30(15-11-17)20-8-12-27-13-9-20/h2-9,12-13,16-17H,10-11,14-15H2,1H3,(H,28,32)(H,29,31)