1-(2-chloroethyloxymethyl)-7-ethoxy-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(2-chloroethyloxymethyl)-7-ethoxy-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(2-chloroethoxymethyl)-7-ethoxy-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(2-chloroethoxymethyl)-7-ethoxy-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(2-chloroethoxymethyl)-7-ethoxy-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(2-chloroethoxymethyl)-7-ethoxy-1,3,4,5-tetrahydro-2-benzothiepin Formula: C15H21ClO2S MolecularWeight: 300.84404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(SCCC2)COCCCl

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(SCCC2)COCCCl

InChI

InChI=1S/C15H21ClO2S/c1-2-18-13-5-6-14-12(10-13)4-3-9-19-15(14)11-17-8-7-16/h5-6,10,15H,2-4,7-9,11H2,1H3