4-(4-bromanylpyrazol-1-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-[3-(tetrahydrofuran-2-ylmethoxy)phenyl]benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-[3-(2-oxolanylmethoxy)phenyl]benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-[3-(tetrahydrofurfuryloxy)phenyl]benzamide Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)N4C=C(C=N4)Br

Isomeric SMILES

C1CC(OC1)COC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)N4C=C(C=N4)Br

InChI

InChI=1S/C21H20BrN3O3/c22-16-12-23-25(13-16)18-8-6-15(7-9-18)21(26)24-17-3-1-4-19(11-17)28-14-20-5-2-10-27-20/h1,3-4,6-9,11-13,20H,2,5,10,14H2,(H,24,26)