1-[(5S)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperidin-1-ium

Systemtic Name: 1-[(5S)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperidin-1-ium Openeye Name: 1-[(5S)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperidin-1-ium CAS Name: 1-[(5S)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperidin-1-ium IUPAC Name: 1-[(5S)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperidin-1-ium Traditional Name: 1-[(5S)-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperidin-1-ium Formula: C19H22NS+ MolecularWeight: 296.44968

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CC3=CC=CC=C3SC4=CC=CC=C24

Isomeric SMILES

C1CC[NH+](CC1)[C@H]2CC3=CC=CC=C3SC4=CC=CC=C24

InChI

InChI=1S/C19H21NS/c1-6-12-20(13-7-1)17-14-15-8-2-4-10-18(15)21-19-11-5-3-9-16(17)19/h2-5,8-11,17H,1,6-7,12-14H2/p+1/t17-/m0/s1