5-bromanyl-3-phenylmethoxy-1-propan-2-yl-pyrazole-4-carbaldehyde

Systemtic Name: 5-bromanyl-3-phenylmethoxy-1-propan-2-yl-pyrazole-4-carbaldehyde Openeye Name: 3-benzyloxy-5-bromo-1-isopropyl-pyrazole-4-carbaldehyde CAS Name: 5-bromo-3-phenylmethoxy-1-propan-2-yl-4-pyrazolecarboxaldehyde IUPAC Name: 5-bromo-3-phenylmethoxy-1-propan-2-ylpyrazole-4-carbaldehyde Traditional Name: 3-benzoxy-5-bromo-1-isopropyl-pyrazole-4-carbaldehyde Formula: C14H15BrN2O2 MolecularWeight: 323.1851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(C(=N1)OCC2=CC=CC=C2)C=O)Br

Isomeric SMILES

CC(C)N1C(=C(C(=N1)OCC2=CC=CC=C2)C=O)Br

InChI

InChI=1S/C14H15BrN2O2/c1-10(2)17-13(15)12(8-18)14(16-17)19-9-11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3