1-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)pyrrolidine

Systemtic Name: 1-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)pyrrolidine Openeye Name: 1-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)pyrrolidine CAS Name: 1-[2-(5-benzo[b][1]benzoxepinylthio)ethyl]pyrrolidine IUPAC Name: 1-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)pyrrolidine Traditional Name: 1-[2-(benzo[b][1]benzoxepin-5-ylthio)ethyl]pyrrolidine Formula: C20H21NOS MolecularWeight: 323.45184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCSC2=CC3=CC=CC=C3OC4=CC=CC=C42

Isomeric SMILES

C1CCN(C1)CCSC2=CC3=CC=CC=C3OC4=CC=CC=C42

InChI

InChI=1S/C20H21NOS/c1-3-9-18-16(7-1)15-20(17-8-2-4-10-19(17)22-18)23-14-13-21-11-5-6-12-21/h1-4,7-10,15H,5-6,11-14H2