2-[4-[(Z)-[1-(4-bromophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]-2-ethoxy-phenoxy]-N-phenethyl-ethanamide

Systemtic Name: 2-[4-[(Z)-[1-(4-bromophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]-2-ethoxy-phenoxy]-N-phenethyl-ethanamide Openeye Name: 2-[4-[(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]-2-ethoxy-phenoxy]-N-phenethyl-acetamide CAS Name: 2-[4-[(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]-2-ethoxyphenoxy]-N-phenethylacetamide IUPAC Name: 2-[4-[(Z)-[1-(4-bromophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]-2-ethoxyphenoxy]-N-phenethylacetamide Traditional Name: 2-[4-[(Z)-[1-(4-bromophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]-2-ethoxy-phenoxy]-N-phenethyl-acetamide Formula: C29H28BrN3O4 MolecularWeight: 562.45432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)Br)C)OCC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C\2/C(=NN(C2=O)C3=CC=C(C=C3)Br)C)OCC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C29H28BrN3O4/c1-3-36-27-18-22(17-25-20(2)32-33(29(25)35)24-12-10-23(30)11-13-24)9-14-26(27)37-19-28(34)31-16-15-21-7-5-4-6-8-21/h4-14,17-18H,3,15-16,19H2,1-2H3,(H,31,34)/b25-17-