N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3,4-diethoxy-benzamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3,4-diethoxy-benzamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]-3,4-diethoxy-benzamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-3,4-diethoxybenzamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]-3,4-diethoxybenzamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]-3,4-diethoxy-benzamide Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=NN(C=C2)CC3=C(C=CC=C3Cl)F)OCC

InChI

InChI=1S/C21H21ClFN3O3/c1-3-28-18-9-8-14(12-19(18)29-4-2)21(27)24-20-10-11-26(25-20)13-15-16(22)6-5-7-17(15)23/h5-12H,3-4,13H2,1-2H3,(H,24,25,27)