3-[1-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]piperidin-4-yl]-5,5-dimethyl-1,3-oxazinan-2-one

Systemtic Name: 3-[1-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]piperidin-4-yl]-5,5-dimethyl-1,3-oxazinan-2-one Openeye Name: 3-[1-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]-4-piperidyl]-5,5-dimethyl-1,3-oxazinan-2-one CAS Name: 3-[1-[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]-4-piperidinyl]-5,5-dimethyl-1,3-oxazinan-2-one IUPAC Name: 3-[1-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]piperidin-4-yl]-5,5-dimethyl-1,3-oxazinan-2-one Traditional Name: 3-[1-[2-[(3,4-dimethoxyphenyl)thio]acetyl]-4-piperidyl]-5,5-dimethyl-1,3-oxazinan-2-one Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)OC1)C2CCN(CC2)C(=O)CSC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1(CN(C(=O)OC1)C2CCN(CC2)C(=O)CSC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C21H30N2O5S/c1-21(2)13-23(20(25)28-14-21)15-7-9-22(10-8-15)19(24)12-29-16-5-6-17(26-3)18(11-16)27-4/h5-6,11,15H,7-10,12-14H2,1-4H3