4-bromanyl-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[4-(3,4-diethoxybenzyl)oxyphenyl]-2-ethyl-pyrazole-3-carboxamide Formula: C23H26BrN3O4 MolecularWeight: 488.37424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=CC=C(C=C2)OCC3=CC(=C(C=C3)OCC)OCC

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=CC=C(C=C2)OCC3=CC(=C(C=C3)OCC)OCC

InChI

InChI=1S/C23H26BrN3O4/c1-4-27-22(19(24)14-25-27)23(28)26-17-8-10-18(11-9-17)31-15-16-7-12-20(29-5-2)21(13-16)30-6-3/h7-14H,4-6,15H2,1-3H3,(H,26,28)