3-(3-bromanylphenoxy)-N-(1-methylpyrazol-3-yl)propanamide

Systemtic Name: 3-(3-bromanylphenoxy)-N-(1-methylpyrazol-3-yl)propanamide Openeye Name: 3-(3-bromophenoxy)-N-(1-methylpyrazol-3-yl)propanamide CAS Name: 3-(3-bromophenoxy)-N-(1-methyl-3-pyrazolyl)propanamide IUPAC Name: 3-(3-bromophenoxy)-N-(1-methylpyrazol-3-yl)propanamide Traditional Name: 3-(3-bromophenoxy)-N-(1-methylpyrazol-3-yl)propionamide Formula: C13H14BrN3O2 MolecularWeight: 324.17316

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)CCOC2=CC(=CC=C2)Br

Isomeric SMILES

CN1C=CC(=N1)NC(=O)CCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H14BrN3O2/c1-17-7-5-12(16-17)15-13(18)6-8-19-11-4-2-3-10(14)9-11/h2-5,7,9H,6,8H2,1H3,(H,15,16,18)