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

Systemtic Name: 2-[4-[(E)-[1-(4-aminocarbonylphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]-2-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(E)-[1-(4-carbamoylphenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(E)-[1-(4-carbamoylphenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]-2-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(E)-[1-(4-carbamoylphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(E)-[1-(4-carbamoylphenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]-2-methoxy-phenoxy]acetate Formula: C21H18N3O6- MolecularWeight: 408.38412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCC(=O)[O-])OC)C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O6/c1-12-16(9-13-3-8-17(18(10-13)29-2)30-11-19(25)26)21(28)24(23-12)15-6-4-14(5-7-15)20(22)27/h3-10H,11H2,1-2H3,(H2,22,27)(H,25,26)/p-1/b16-9+