2-[4-[(E)-[1-(3-bromophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]-2-methoxy-phenoxy]ethanamide

Systemtic Name: 2-[4-[(E)-[1-(3-bromophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]-2-methoxy-phenoxy]ethanamide Openeye Name: 2-[4-[(E)-[1-(3-bromophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]-2-methoxy-phenoxy]acetamide CAS Name: 2-[4-[(E)-[1-(3-bromophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]-2-methoxyphenoxy]acetamide IUPAC Name: 2-[4-[(E)-[1-(3-bromophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]-2-methoxyphenoxy]acetamide Traditional Name: 2-[4-[(E)-[1-(3-bromophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]-2-methoxy-phenoxy]acetamide Formula: C20H18BrN3O4 MolecularWeight: 444.27862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCC(=O)N)OC)C3=CC(=CC=C3)Br

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC(=C(C=C2)OCC(=O)N)OC)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H18BrN3O4/c1-12-16(20(26)24(23-12)15-5-3-4-14(21)10-15)8-13-6-7-17(18(9-13)27-2)28-11-19(22)25/h3-10H,11H2,1-2H3,(H2,22,25)/b16-8+