5-bromanyl-N-[3-(2,3,5-trimethylphenoxy)propyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[3-(2,3,5-trimethylphenoxy)propyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[3-(2,3,5-trimethylphenoxy)propyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[3-(2,3,5-trimethylphenoxy)propyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[3-(2,3,5-trimethylphenoxy)propyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[3-(2,3,5-trimethylphenoxy)propyl]nicotinamide Formula: C18H21BrN2O2 MolecularWeight: 377.27554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCNC(=O)C2=CC(=CN=C2)Br)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCNC(=O)C2=CC(=CN=C2)Br)C)C

InChI

InChI=1S/C18H21BrN2O2/c1-12-7-13(2)14(3)17(8-12)23-6-4-5-21-18(22)15-9-16(19)11-20-10-15/h7-11H,4-6H2,1-3H3,(H,21,22)