tert-butyl (2S)-3,3-dimethyl-2-[2-oxidanylidene-3-[(6-prop-1-en-2-ylpyridin-2-yl)methyl]imidazolidin-1-yl]butanoate

Systemtic Name: tert-butyl (2S)-3,3-dimethyl-2-[2-oxidanylidene-3-[(6-prop-1-en-2-ylpyridin-2-yl)methyl]imidazolidin-1-yl]butanoate Openeye Name: tert-butyl (2S)-2-[3-[(6-isopropenyl-2-pyridyl)methyl]-2-oxo-imidazolidin-1-yl]-3,3-dimethyl-butanoate CAS Name: (2S)-3,3-dimethyl-2-[3-[[6-(1-methylethenyl)-2-pyridinyl]methyl]-2-oxo-1-imidazolidinyl]butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3,3-dimethyl-2-[2-oxo-3-[(6-prop-1-en-2-ylpyridin-2-yl)methyl]imidazolidin-1-yl]butanoate Traditional Name: (2S)-2-[3-[(6-isopropenyl-2-pyridyl)methyl]-2-keto-imidazolidin-1-yl]-3,3-dimethyl-butyric acid tert-butyl ester Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=NC(=CC=C1)CN2CCN(C2=O)C(C(=O)OC(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(=C)C1=NC(=CC=C1)CN2CCN(C2=O)[C@H](C(=O)OC(C)(C)C)C(C)(C)C

InChI

InChI=1S/C22H33N3O3/c1-15(2)17-11-9-10-16(23-17)14-24-12-13-25(20(24)27)18(21(3,4)5)19(26)28-22(6,7)8/h9-11,18H,1,12-14H2,2-8H3/t18-/m1/s1