2-[2-bromanyl-6-ethoxy-4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[2-bromanyl-6-ethoxy-4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[2-bromo-6-ethoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]-N-phenyl-acetamide CAS Name: 2-[2-bromo-6-ethoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenoxy]-N-phenylacetamide IUPAC Name: 2-[2-bromo-6-ethoxy-4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenoxy]-N-phenylacetamide Traditional Name: 2-[2-bromo-6-ethoxy-4-[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]phenoxy]-N-phenyl-acetamide Formula: C27H24BrN3O4 MolecularWeight: 534.40116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)Br)OCC(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=NN(C2=O)C3=CC=CC=C3)C)Br)OCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H24BrN3O4/c1-3-34-24-16-19(14-22-18(2)30-31(27(22)33)21-12-8-5-9-13-21)15-23(28)26(24)35-17-25(32)29-20-10-6-4-7-11-20/h4-16H,3,17H2,1-2H3,(H,29,32)/b22-14+