O5-ethyl O3,O4-dimethyl 2-phenyl-3,4-dihydropyrazole-3,4,5-tricarboxylate

Systemtic Name: O5-ethyl O3,O4-dimethyl 2-phenyl-3,4-dihydropyrazole-3,4,5-tricarboxylate Openeye Name: O5-ethyl O3,O4-dimethyl 2-phenyl-3,4-dihydropyrazole-3,4,5-tricarboxylate CAS Name: 2-phenyl-3,4-dihydropyrazole-3,4,5-tricarboxylic acid O5-ethyl ester O3,O4-dimethyl ester IUPAC Name: 5-O-ethyl 3-O,4-O-dimethyl 2-phenyl-3,4-dihydropyrazole-3,4,5-tricarboxylate Traditional Name: 1-phenyl-2-pyrazoline-3,4,5-tricarboxylic acid O3-ethyl ester O4,O5-dimethyl ester Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(C1C(=O)OC)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=NN(C(C1C(=O)OC)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C16H18N2O6/c1-4-24-15(20)12-11(14(19)22-2)13(16(21)23-3)18(17-12)10-8-6-5-7-9-10/h5-9,11,13H,4H2,1-3H3