ethyl (5R)-5-[3,3-dimethyl-5-oxidanylidene-2-(phenylmethyl)pyrazolidin-1-yl]carbonyl-5-methyl-1,4-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl (5R)-5-[3,3-dimethyl-5-oxidanylidene-2-(phenylmethyl)pyrazolidin-1-yl]carbonyl-5-methyl-1,4-dihydropyrazole-3-carboxylate Openeye Name: ethyl (5R)-5-(2-benzyl-3,3-dimethyl-5-oxo-pyrazolidine-1-carbonyl)-5-methyl-1,4-dihydropyrazole-3-carboxylate CAS Name: (5R)-5-[[3,3-dimethyl-5-oxo-2-(phenylmethyl)-1-pyrazolidinyl]-oxomethyl]-5-methyl-1,4-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5R)-5-(2-benzyl-3,3-dimethyl-5-oxopyrazolidine-1-carbonyl)-5-methyl-1,4-dihydropyrazole-3-carboxylate Traditional Name: (5R)-5-(2-benzyl-5-keto-3,3-dimethyl-pyrazolidine-1-carbonyl)-5-methyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(C1)(C)C(=O)N2C(=O)CC(N2CC3=CC=CC=C3)(C)C

Isomeric SMILES

CCOC(=O)C1=NN[C@@](C1)(C)C(=O)N2C(=O)CC(N2CC3=CC=CC=C3)(C)C

InChI

InChI=1S/C20H26N4O4/c1-5-28-17(26)15-11-20(4,22-21-15)18(27)24-16(25)12-19(2,3)23(24)13-14-9-7-6-8-10-14/h6-10,22H,5,11-13H2,1-4H3/t20-/m1/s1