ethyl 4-(3-azabicyclo[2.2.2]octan-3-yl)-4-oxidanylidene-2-(phenylmethyl)butanoate

Systemtic Name: ethyl 4-(3-azabicyclo[2.2.2]octan-3-yl)-4-oxidanylidene-2-(phenylmethyl)butanoate Openeye Name: ethyl 4-(3-azabicyclo[2.2.2]octan-3-yl)-2-benzyl-4-oxo-butanoate CAS Name: 4-(3-azabicyclo[2.2.2]octan-3-yl)-4-oxo-2-(phenylmethyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(3-azabicyclo[2.2.2]octan-3-yl)-2-benzyl-4-oxobutanoate Traditional Name: 4-(3-azabicyclo[2.2.2]octan-3-yl)-2-benzyl-4-keto-butyric acid ethyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)CC(=O)N2CC3CCC2CC3

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)CC(=O)N2CC3CCC2CC3

InChI

InChI=1S/C20H27NO3/c1-2-24-20(23)17(12-15-6-4-3-5-7-15)13-19(22)21-14-16-8-10-18(21)11-9-16/h3-7,16-18H,2,8-14H2,1H3