N-[4-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[2-(2-bromanyl-4-chloranyl-phenoxy)ethanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]-2-methoxy-phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[2-(2-bromo-4-chlorophenoxy)-1-oxoethyl]amino]-2-methoxyphenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]-2-methoxyphenyl]pyridine-3-carboxamide Traditional Name: N-[4-[[2-(2-bromo-4-chloro-phenoxy)acetyl]amino]-2-methoxy-phenyl]nicotinamide Formula: C21H17BrClN3O4 MolecularWeight: 490.73438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)COC2=C(C=C(C=C2)Cl)Br)NC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)COC2=C(C=C(C=C2)Cl)Br)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H17BrClN3O4/c1-29-19-10-15(5-6-17(19)26-21(28)13-3-2-8-24-11-13)25-20(27)12-30-18-7-4-14(23)9-16(18)22/h2-11H,12H2,1H3,(H,25,27)(H,26,28)