5-ethoxy-6-ethyl-2,3-dimethoxy-benzo[b][1]benzothiepine

Systemtic Name: 5-ethoxy-6-ethyl-2,3-dimethoxy-benzo[b][1]benzothiepine Openeye Name: 5-ethoxy-6-ethyl-2,3-dimethoxy-benzo[b][1]benzothiepine CAS Name: 5-ethoxy-6-ethyl-2,3-dimethoxybenzo[b][1]benzothiepin IUPAC Name: 5-ethoxy-6-ethyl-2,3-dimethoxybenzo[b][1]benzothiepine Traditional Name: 5-ethoxy-6-ethyl-2,3-dimethoxy-benzo[b][1]benzothiepin Formula: C20H22O3S MolecularWeight: 342.45188

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC(=C(C=C2SC3=CC=CC=C31)OC)OC)OCC

Isomeric SMILES

CCC1=C(C2=CC(=C(C=C2SC3=CC=CC=C31)OC)OC)OCC

InChI

InChI=1S/C20H22O3S/c1-5-13-14-9-7-8-10-18(14)24-19-12-17(22-4)16(21-3)11-15(19)20(13)23-6-2/h7-12H,5-6H2,1-4H3