2-[(E)-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)methylideneamino]oxyethyl benzoate

Systemtic Name: 2-[(E)-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)methylideneamino]oxyethyl benzoate Openeye Name: 2-[(E)-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)methyleneamino]oxyethyl benzoate CAS Name: benzoic acid 2-[(E)-(1,3-dimethyl-5-phenoxy-4-pyrazolyl)methylideneamino]oxyethyl ester IUPAC Name: 2-[(E)-(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxyethyl benzoate Traditional Name: benzoic acid 2-[(E)-(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)methyleneamino]oxyethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NOCCOC(=O)C2=CC=CC=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(=C1/C=N/OCCOC(=O)C2=CC=CC=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3O4/c1-16-19(20(24(2)23-16)28-18-11-7-4-8-12-18)15-22-27-14-13-26-21(25)17-9-5-3-6-10-17/h3-12,15H,13-14H2,1-2H3/b22-15+