1-(4-chloranylbutyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(4-chloranylbutyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(4-chlorobutyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(4-chlorobutyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(4-chlorobutyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(4-chlorobutyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin Formula: C16H23ClO2S MolecularWeight: 314.87062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(SCCCC2=C1)CCCCCl)OC

Isomeric SMILES

COC1=C(C=C2C(SCCCC2=C1)CCCCCl)OC

InChI

InChI=1S/C16H23ClO2S/c1-18-14-10-12-6-5-9-20-16(7-3-4-8-17)13(12)11-15(14)19-2/h10-11,16H,3-9H2,1-2H3