dimethyl (3S,4R)-2,5-diphenyl-3-propan-2-yl-4H-pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl (3S,4R)-2,5-diphenyl-3-propan-2-yl-4H-pyrazole-3,4-dicarboxylate Openeye Name: dimethyl (3S,4R)-3-isopropyl-2,5-diphenyl-4H-pyrazole-3,4-dicarboxylate CAS Name: (3S,4R)-2,5-diphenyl-3-propan-2-yl-4H-pyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3S,4R)-2,5-diphenyl-3-propan-2-yl-4H-pyrazole-3,4-dicarboxylate Traditional Name: (3S,4R)-3-isopropyl-2,5-diphenyl-2-pyrazoline-3,4-dicarboxylic acid dimethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)[C@]1([C@H](C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H24N2O4/c1-15(2)22(21(26)28-4)18(20(25)27-3)19(16-11-7-5-8-12-16)23-24(22)17-13-9-6-10-14-17/h5-15,18H,1-4H3/t18-,22+/m1/s1