2-[[(4S,5S)-3-tert-butyl-4-methyl-4,5-dihydro-1,2-oxazol-5-yl]carbonyl]-5,5-dimethyl-1-(phenylmethyl)pyrazolidin-3-one

Systemtic Name: 2-[[(4S,5S)-3-tert-butyl-4-methyl-4,5-dihydro-1,2-oxazol-5-yl]carbonyl]-5,5-dimethyl-1-(phenylmethyl)pyrazolidin-3-one Openeye Name: 1-benzyl-2-[(4S,5S)-3-tert-butyl-4-methyl-4,5-dihydroisoxazole-5-carbonyl]-5,5-dimethyl-pyrazolidin-3-one CAS Name: 2-[[(4S,5S)-3-tert-butyl-4-methyl-4,5-dihydroisoxazol-5-yl]-oxomethyl]-5,5-dimethyl-1-(phenylmethyl)-3-pyrazolidinone IUPAC Name: 1-benzyl-2-[(4S,5S)-3-tert-butyl-4-methyl-4,5-dihydro-1,2-oxazole-5-carbonyl]-5,5-dimethylpyrazolidin-3-one Traditional Name: 1-benzyl-2-[(4S,5S)-3-tert-butyl-4-methyl-2-isoxazoline-5-carbonyl]-5,5-dimethyl-pyrazolidin-3-one Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(ON=C1C(C)(C)C)C(=O)N2C(=O)CC(N2CC3=CC=CC=C3)(C)C

Isomeric SMILES

C[C@@H]1[C@H](ON=C1C(C)(C)C)C(=O)N2C(=O)CC(N2CC3=CC=CC=C3)(C)C

InChI

InChI=1S/C21H29N3O3/c1-14-17(27-22-18(14)20(2,3)4)19(26)24-16(25)12-21(5,6)23(24)13-15-10-8-7-9-11-15/h7-11,14,17H,12-13H2,1-6H3/t14-,17+/m1/s1