N-(4-acetamidophenyl)-1-[(4-bromanylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-1-[(4-bromanylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-[(4-bromophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-acetamidophenyl)-1-[(4-bromophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-[(4-bromophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-[(4-bromophenoxy)methyl]pyrazole-3-carboxamide Formula: C19H17BrN4O3 MolecularWeight: 429.26728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN4O3/c1-13(25)21-15-4-6-16(7-5-15)22-19(26)18-10-11-24(23-18)12-27-17-8-2-14(20)3-9-17/h2-11H,12H2,1H3,(H,21,25)(H,22,26)