1-(2-chloroethyloxymethyl)-7-methoxy-8-(trifluoromethyl)-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(2-chloroethyloxymethyl)-7-methoxy-8-(trifluoromethyl)-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(2-chloroethoxymethyl)-7-methoxy-8-(trifluoromethyl)-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(2-chloroethoxymethyl)-7-methoxy-8-(trifluoromethyl)-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(2-chloroethoxymethyl)-7-methoxy-8-(trifluoromethyl)-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(2-chloroethoxymethyl)-7-methoxy-8-(trifluoromethyl)-1,3,4,5-tetrahydro-2-benzothiepin Formula: C15H18ClF3O2S MolecularWeight: 354.81543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(SCCCC2=C1)COCCCl)C(F)(F)F

Isomeric SMILES

COC1=C(C=C2C(SCCCC2=C1)COCCCl)C(F)(F)F

InChI

InChI=1S/C15H18ClF3O2S/c1-20-13-7-10-3-2-6-22-14(9-21-5-4-16)11(10)8-12(13)15(17,18)19/h7-8,14H,2-6,9H2,1H3