1-(2-chloroethyloxymethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(2-chloroethyloxymethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(2-chloroethoxymethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(2-chloroethoxymethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(2-chloroethoxymethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(2-chloroethoxymethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepin Formula: C20H23ClO2S MolecularWeight: 362.91342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(SCC(C2)C3=CC=CC=C3)COCCCl

Isomeric SMILES

COC1=CC=CC2=C1C(SCC(C2)C3=CC=CC=C3)COCCCl

InChI

InChI=1S/C20H23ClO2S/c1-22-18-9-5-8-16-12-17(15-6-3-2-4-7-15)14-24-19(20(16)18)13-23-11-10-21/h2-9,17,19H,10-14H2,1H3