1-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-[(3,4-diethoxyphenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-[(3,4-diethoxyphenyl)methyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-2-chloro-phenoxy)methyl]-N-[(3,4-diethoxyphenyl)methyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-2-chlorophenoxy)methyl]-N-[(3,4-diethoxyphenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-2-chlorophenoxy)methyl]-N-[(3,4-diethoxyphenyl)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-2-chloro-phenoxy)methyl]-N-(3,4-diethoxybenzyl)pyrazole-3-carboxamide Formula: C22H23BrClN3O4 MolecularWeight: 508.79272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)Br)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)Br)Cl)OCC

InChI

InChI=1S/C22H23BrClN3O4/c1-3-29-20-7-5-15(11-21(20)30-4-2)13-25-22(28)18-9-10-27(26-18)14-31-19-8-6-16(23)12-17(19)24/h5-12H,3-4,13-14H2,1-2H3,(H,25,28)