(2S)-2-[(2R,4R)-2-tert-butyl-1,3-dioxan-4-yl]-1-(phenylmethyl)piperidin-4-one

Systemtic Name: (2S)-2-[(2R,4R)-2-tert-butyl-1,3-dioxan-4-yl]-1-(phenylmethyl)piperidin-4-one Openeye Name: (2S)-1-benzyl-2-[(2R,4R)-2-tert-butyl-1,3-dioxan-4-yl]piperidin-4-one CAS Name: (2S)-2-[(2R,4R)-2-tert-butyl-1,3-dioxan-4-yl]-1-(phenylmethyl)-4-piperidinone IUPAC Name: (2S)-1-benzyl-2-[(2R,4R)-2-tert-butyl-1,3-dioxan-4-yl]piperidin-4-one Traditional Name: (2S)-1-benzyl-2-[(2R,4R)-2-tert-butyl-1,3-dioxan-4-yl]-4-piperidone Formula: C20H29NO3 MolecularWeight: 331.44916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1OCCC(O1)C2CC(=O)CCN2CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)[C@@H]1OCC[C@@H](O1)[C@@H]2CC(=O)CCN2CC3=CC=CC=C3

InChI

InChI=1S/C20H29NO3/c1-20(2,3)19-23-12-10-18(24-19)17-13-16(22)9-11-21(17)14-15-7-5-4-6-8-15/h4-8,17-19H,9-14H2,1-3H3/t17-,18+,19+/m0/s1