O5-ethyl O4-methyl (4S)-2-phenyl-3,4-dihydropyrazole-4,5-dicarboxylate

Systemtic Name: O5-ethyl O4-methyl (4S)-2-phenyl-3,4-dihydropyrazole-4,5-dicarboxylate Openeye Name: O5-ethyl O4-methyl (4S)-2-phenyl-3,4-dihydropyrazole-4,5-dicarboxylate CAS Name: (4S)-2-phenyl-3,4-dihydropyrazole-4,5-dicarboxylic acid O5-ethyl ester O4-methyl ester IUPAC Name: 5-O-ethyl 4-O-methyl (4S)-2-phenyl-3,4-dihydropyrazole-4,5-dicarboxylate Traditional Name: (4S)-1-phenyl-2-pyrazoline-3,4-dicarboxylic acid O3-ethyl ester O4-methyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(CC1C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=NN(C[C@@H]1C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O4/c1-3-20-14(18)12-11(13(17)19-2)9-16(15-12)10-7-5-4-6-8-10/h4-8,11H,3,9H2,1-2H3/t11-/m0/s1