5-chloranyl-3-ethyl-1-(phenylmethyl)pyrazole-4-carbaldehyde

Systemtic Name: 5-chloranyl-3-ethyl-1-(phenylmethyl)pyrazole-4-carbaldehyde Openeye Name: 1-benzyl-5-chloro-3-ethyl-pyrazole-4-carbaldehyde CAS Name: 5-chloro-3-ethyl-1-(phenylmethyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-benzyl-5-chloro-3-ethylpyrazole-4-carbaldehyde Traditional Name: 1-benzyl-5-chloro-3-ethyl-pyrazole-4-carbaldehyde Formula: C13H13ClN2O MolecularWeight: 248.70812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C=O)Cl)CC2=CC=CC=C2

Isomeric SMILES

CCC1=NN(C(=C1C=O)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C13H13ClN2O/c1-2-12-11(9-17)13(14)16(15-12)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3