1-(3-chloranylbenzo[b][1]benzothiepin-5-yl)pyrrolidine

Systemtic Name: 1-(3-chloranylbenzo[b][1]benzothiepin-5-yl)pyrrolidine Openeye Name: 1-(3-chlorobenzo[b][1]benzothiepin-5-yl)pyrrolidine CAS Name: 1-(3-chloro-5-benzo[b][1]benzothiepinyl)pyrrolidine IUPAC Name: 1-(3-chlorobenzo[b][1]benzothiepin-5-yl)pyrrolidine Traditional Name: 1-(3-chlorobenzo[b][1]benzothiepin-5-yl)pyrrolidine Formula: C18H16ClNS MolecularWeight: 313.84434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC3=CC=CC=C3SC4=C2C=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)C2=CC3=CC=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C18H16ClNS/c19-14-7-8-18-15(12-14)16(20-9-3-4-10-20)11-13-5-1-2-6-17(13)21-18/h1-2,5-8,11-12H,3-4,9-10H2