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

Systemtic Name: 2-[2-bromanyl-6-ethoxy-4-[(E)-(5-oxidanylidene-1-phenyl-3-propyl-pyrazol-4-ylidene)methyl]phenoxy]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[2-bromo-6-ethoxy-4-[(E)-(5-oxo-1-phenyl-3-propyl-pyrazol-4-ylidene)methyl]phenoxy]-N-(o-tolyl)acetamide CAS Name: 2-[2-bromo-6-ethoxy-4-[(E)-(5-oxo-1-phenyl-3-propyl-4-pyrazolylidene)methyl]phenoxy]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[2-bromo-6-ethoxy-4-[(E)-(5-oxo-1-phenyl-3-propylpyrazol-4-ylidene)methyl]phenoxy]-N-(2-methylphenyl)acetamide Traditional Name: 2-[2-bromo-6-ethoxy-4-[(E)-(5-keto-1-phenyl-3-propyl-2-pyrazolin-4-ylidene)methyl]phenoxy]-N-(o-tolyl)acetamide Formula: C30H30BrN3O4 MolecularWeight: 576.4809

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CC2=CC(=C(C(=C2)Br)OCC(=O)NC3=CC=CC=C3C)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C/C2=CC(=C(C(=C2)Br)OCC(=O)NC3=CC=CC=C3C)OCC)C4=CC=CC=C4

InChI

InChI=1S/C30H30BrN3O4/c1-4-11-26-23(30(36)34(33-26)22-13-7-6-8-14-22)16-21-17-24(31)29(27(18-21)37-5-2)38-19-28(35)32-25-15-10-9-12-20(25)3/h6-10,12-18H,4-5,11,19H2,1-3H3,(H,32,35)/b23-16+