N-[3-[[(E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoyl]amino]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[[(E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoyl]amino]phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[[(E)-3-(3-fluoro-4-methoxy-phenyl)prop-2-enoyl]amino]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[[(E)-3-(3-fluoro-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[[(E)-3-(3-fluoro-4-methoxyphenyl)prop-2-enoyl]amino]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[[(E)-3-(3-fluoro-4-methoxy-phenyl)acryloyl]amino]phenyl]nicotinamide Formula: C22H18FN3O3 MolecularWeight: 391.395023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CN=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=CC(=C2)NC(=O)C3=CN=CC=C3)F

InChI

InChI=1S/C22H18FN3O3/c1-29-20-9-7-15(12-19(20)23)8-10-21(27)25-17-5-2-6-18(13-17)26-22(28)16-4-3-11-24-14-16/h2-14H,1H3,(H,25,27)(H,26,28)/b10-8+