4-(3-bromanylphenoxy)-N-(1-methylpyrazol-3-yl)butanamide

Systemtic Name: 4-(3-bromanylphenoxy)-N-(1-methylpyrazol-3-yl)butanamide Openeye Name: 4-(3-bromophenoxy)-N-(1-methylpyrazol-3-yl)butanamide CAS Name: 4-(3-bromophenoxy)-N-(1-methyl-3-pyrazolyl)butanamide IUPAC Name: 4-(3-bromophenoxy)-N-(1-methylpyrazol-3-yl)butanamide Traditional Name: 4-(3-bromophenoxy)-N-(1-methylpyrazol-3-yl)butyramide Formula: C14H16BrN3O2 MolecularWeight: 338.19974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)CCCOC2=CC(=CC=C2)Br

Isomeric SMILES

CN1C=CC(=N1)NC(=O)CCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H16BrN3O2/c1-18-8-7-13(17-18)16-14(19)6-3-9-20-12-5-2-4-11(15)10-12/h2,4-5,7-8,10H,3,6,9H2,1H3,(H,16,17,19)