N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-phenoxy-benzamide

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-phenoxy-benzamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-phenoxy-benzamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-3-phenoxybenzamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-phenoxybenzamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-phenoxy-benzamide Formula: C19H18BrN3O2 MolecularWeight: 400.26912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C19H18BrN3O2/c20-16-13-22-23(14-16)11-5-10-21-19(24)15-6-4-9-18(12-15)25-17-7-2-1-3-8-17/h1-4,6-9,12-14H,5,10-11H2,(H,21,24)