5-(3-chloranylpropoxy)-3-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrazole

Systemtic Name: 5-(3-chloranylpropoxy)-3-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrazole Openeye Name: 1-benzyl-5-(3-chloropropoxy)-3-(3,4-dimethoxyphenyl)pyrazole CAS Name: 5-(3-chloropropoxy)-3-(3,4-dimethoxyphenyl)-1-(phenylmethyl)pyrazole IUPAC Name: 1-benzyl-5-(3-chloropropoxy)-3-(3,4-dimethoxyphenyl)pyrazole Traditional Name: 1-benzyl-5-(3-chloropropoxy)-3-(3,4-dimethoxyphenyl)pyrazole Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=C2)OCCCCl)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=C2)OCCCCl)CC3=CC=CC=C3)OC

InChI

InChI=1S/C21H23ClN2O3/c1-25-19-10-9-17(13-20(19)26-2)18-14-21(27-12-6-11-22)24(23-18)15-16-7-4-3-5-8-16/h3-5,7-10,13-14H,6,11-12,15H2,1-2H3