N-(2-morpholin-4-ium-4-ylethyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C19H23N2O2S+ MolecularWeight: 343.46312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C19H22N2O2S/c22-19(20-7-8-21-9-11-23-12-10-21)17-13-15-6-5-14-3-1-2-4-16(14)18(15)24-17/h1-4,13H,5-12H2,(H,20,22)/p+1