1-(2-chloroethyloxymethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(2-chloroethyloxymethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(2-chloroethoxymethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(2-chloroethoxymethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(2-chloroethoxymethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(2-chloroethoxymethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin Formula: C20H29ClO3S MolecularWeight: 384.96046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(CC(CSC2COCCCl)C3CCCC3)C=C1)OC

Isomeric SMILES

COC1=C(C2=C(CC(CSC2COCCCl)C3CCCC3)C=C1)OC

InChI

InChI=1S/C20H29ClO3S/c1-22-17-8-7-15-11-16(14-5-3-4-6-14)13-25-18(12-24-10-9-21)19(15)20(17)23-2/h7-8,14,16,18H,3-6,9-13H2,1-2H3