6-(3-oxidanylpropyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-ol

Systemtic Name: 6-(3-oxidanylpropyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Openeye Name: 6-(3-hydroxypropyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-ol CAS Name: 6-(3-hydroxypropyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-ol IUPAC Name: 6-(3-hydroxypropyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Traditional Name: 6-(3-hydroxypropyl)-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Formula: C17H18O2S MolecularWeight: 286.38862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(C3=CC=CC=C3S2)O)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(C(C3=CC=CC=C3S2)O)CCCO

InChI

InChI=1S/C17H18O2S/c18-11-5-8-13-12-6-1-3-9-15(12)20-16-10-4-2-7-14(16)17(13)19/h1-4,6-7,9-10,13,17-19H,5,8,11H2