2-[2-[(Z)-[3-methyl-5-oxidanylidene-1-(phenylmethyl)pyrazol-4-ylidene]methyl]phenoxy]ethanoate

Systemtic Name: 2-[2-[(Z)-[3-methyl-5-oxidanylidene-1-(phenylmethyl)pyrazol-4-ylidene]methyl]phenoxy]ethanoate Openeye Name: 2-[2-[(Z)-(1-benzyl-3-methyl-5-oxo-pyrazol-4-ylidene)methyl]phenoxy]acetate CAS Name: 2-[2-[(Z)-[3-methyl-5-oxo-1-(phenylmethyl)-4-pyrazolylidene]methyl]phenoxy]acetate IUPAC Name: 2-[2-[(Z)-(1-benzyl-3-methyl-5-oxopyrazol-4-ylidene)methyl]phenoxy]acetate Traditional Name: 2-[2-[(Z)-(1-benzyl-5-keto-3-methyl-2-pyrazolin-4-ylidene)methyl]phenoxy]acetate Formula: C20H17N2O4- MolecularWeight: 349.35998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=CC=C2OCC(=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=CC=C2OCC(=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O4/c1-14-17(11-16-9-5-6-10-18(16)26-13-19(23)24)20(25)22(21-14)12-15-7-3-2-4-8-15/h2-11H,12-13H2,1H3,(H,23,24)/p-1/b17-11-