N-[(4-butoxy-3-methoxy-phenyl)methyl]-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-1-phenyl-pyrazole-3-carboxamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-1-phenyl-pyrazole-3-carboxamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=NN(C=C2)C3=CC=CC=C3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=NN(C=C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H25N3O3/c1-3-4-14-28-20-11-10-17(15-21(20)27-2)16-23-22(26)19-12-13-25(24-19)18-8-6-5-7-9-18/h5-13,15H,3-4,14,16H2,1-2H3,(H,23,26)