1-[[2-[(4-chloranylphenoxy)methyl]-2-methyl-4-propan-2-yl-1,3-oxathiolan-5-yl]methyl]-3,3-dimethyl-piperidine

Systemtic Name: 1-[[2-[(4-chloranylphenoxy)methyl]-2-methyl-4-propan-2-yl-1,3-oxathiolan-5-yl]methyl]-3,3-dimethyl-piperidine Openeye Name: 1-[[2-[(4-chlorophenoxy)methyl]-4-isopropyl-2-methyl-1,3-oxathiolan-5-yl]methyl]-3,3-dimethyl-piperidine CAS Name: 1-[[2-[(4-chlorophenoxy)methyl]-2-methyl-4-propan-2-yl-1,3-oxathiolan-5-yl]methyl]-3,3-dimethylpiperidine IUPAC Name: 1-[[2-[(4-chlorophenoxy)methyl]-2-methyl-4-propan-2-yl-1,3-oxathiolan-5-yl]methyl]-3,3-dimethylpiperidine Traditional Name: 1-[[2-[(4-chlorophenoxy)methyl]-4-isopropyl-2-methyl-1,3-oxathiolan-5-yl]methyl]-3,3-dimethyl-piperidine Formula: C22H34ClNO2S MolecularWeight: 412.02886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(OC(S1)(C)COC2=CC=C(C=C2)Cl)CN3CCCC(C3)(C)C

Isomeric SMILES

CC(C)C1C(OC(S1)(C)COC2=CC=C(C=C2)Cl)CN3CCCC(C3)(C)C

InChI

InChI=1S/C22H34ClNO2S/c1-16(2)20-19(13-24-12-6-11-21(3,4)14-24)26-22(5,27-20)15-25-18-9-7-17(23)8-10-18/h7-10,16,19-20H,6,11-15H2,1-5H3